data_2lki_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 2lki _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.949 0.404 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -94.1 -55.03 3.35 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.888 0.851 . . . . 0.0 109.343 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -78.21 -9.2 59.1 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.593 -163.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -53.2 -32.48 48.25 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.551 0.74 . . . . 0.0 111.887 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -66.12 -50.64 63.32 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 124.576 1.151 . . . . 0.0 111.074 -177.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.71 -29.58 63.5 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.503 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 90.1 t -67.82 -48.28 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.845 0.458 . . . . 0.0 109.995 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -70.3 -28.26 65.04 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.538 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 44.0 t30 -63.13 -46.52 86.88 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.326 0.651 . . . . 0.0 109.831 173.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.57 -53.86 42.45 Favored 'Isoleucine or valine' 0 C--N 1.351 0.643 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.258 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.54 -34.8 79.09 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.195 0.31 . . . . 0.0 110.551 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.56 -20.53 71.96 Favored Glycine 0 C--N 1.343 0.963 0 CA-C-O 119.947 -0.363 . . . . 0.0 113.398 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -86.06 -56.9 3.24 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.634 0.774 . . . . 0.0 111.059 173.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.07 -54.0 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.602 1.161 . . . . 0.0 111.141 -173.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.52 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 64.6 mt -80.61 -14.53 58.1 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 64.22 62.0 0.87 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.835 1.254 . . . . 0.0 110.863 172.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.632 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 1.7 mm? -86.26 -26.09 25.19 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.3 172.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.43 -83.94 0.14 Allowed Glycine 0 C--N 1.348 1.217 0 O-C-N 124.048 0.843 . . . . 0.0 113.256 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.18 -25.67 14.19 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.641 0.776 . . . . 0.0 111.025 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.632 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.26 -28.03 68.4 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.209 0.603 . . . . 0.0 111.078 -175.388 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.3 pttt -58.76 -34.0 70.91 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.228 0.611 . . . . 0.0 111.369 173.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -90.81 -10.61 42.16 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.98 0.912 . . . . 0.0 111.803 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.5 t -97.51 -7.06 32.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.701 0.401 . . . . 0.0 111.52 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -103.07 147.57 26.8 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 49.8 p -113.82 -172.56 2.11 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.673 0.789 . . . . 0.0 110.653 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.88 -53.46 57.04 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 123.313 0.645 . . . . 0.0 111.658 -178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -69.54 -5.46 24.41 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -77.95 150.42 34.0 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-O 121.014 0.435 . . . . 0.0 110.365 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.2 t -83.49 151.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.928 -174.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.1 mt -114.82 -62.53 1.59 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.024 0.53 . . . . 0.0 109.614 173.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 tt -65.61 110.48 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.77 -40.71 2.37 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 116.366 -0.379 . . . . 0.0 112.522 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -77.63 -40.71 40.96 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.13 0.49 . . . . 0.0 110.54 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.513 HG23 HD13 ' A' ' 17' ' ' LEU . 39.8 mm -84.51 121.92 75.01 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 175.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.05 -17.42 31.77 Favored 'Trans proline' 0 C--N 1.371 1.744 0 C-N-CA 122.648 2.232 . . . . 0.0 112.155 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.52 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 19.5 mm-40 -93.92 -12.53 28.63 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.987 0.915 . . . . 0.0 111.389 -172.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.425 HD21 HD13 ' A' ' 15' ' ' LEU . 2.9 tm? -76.92 94.89 4.0 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.44 ' H ' ' HB2' ' A' ' 41' ' ' ALA . 16.6 t70 -132.45 -168.82 2.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.184 0.994 . . . . 0.0 110.005 -171.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.491 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -56.07 -72.92 0.07 Allowed 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 125.988 1.715 . . . . 0.0 114.599 -170.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.45 -21.11 62.83 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 121.165 -0.959 . . . . 0.0 110.845 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.44 ' HB2' ' H ' ' A' ' 38' ' ' ASP . . . -68.37 -34.62 76.39 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.342 177.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.491 HG22 ' O ' ' A' ' 39' ' ' SER . 34.3 m -70.58 -38.06 72.07 Favored 'Isoleucine or valine' 0 C--N 1.372 1.556 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -59.46 -43.34 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.417 0.627 . . . . 0.0 110.161 176.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.26 -45.94 85.91 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.053 -1.43 . . . . 0.0 111.482 -175.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.433 HG21 ' HA ' ' A' ' 42' ' ' VAL . 28.2 m -68.74 -33.62 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-O 118.894 -0.574 . . . . 0.0 111.533 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.512 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.5 mt -60.42 -52.25 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.513 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 40.1 m -54.18 -46.23 72.31 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 124.646 1.217 . . . . 0.0 110.224 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.403 ' O ' ' HD2' ' A' ' 52' ' ' TYR . . . -59.89 -42.77 94.55 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.073 0.949 . . . . 0.0 112.251 178.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.84 -46.82 78.07 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.348 0.659 . . . . 0.0 110.213 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.1 mm-40 -56.82 -45.89 82.01 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 124.128 0.892 . . . . 0.0 110.529 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 47' ' ' THR . 67.2 mm-40 -59.09 -64.11 1.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 O-C-N 124.245 0.966 . . . . 0.0 111.281 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.403 ' HD2' ' O ' ' A' ' 48' ' ' ALA . 83.1 m-85 -66.96 -37.46 84.3 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.653 0.781 . . . . 0.0 112.719 -169.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -91.65 -6.05 52.82 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 119.35 -0.357 . . . . 0.0 111.797 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 63.11 34.63 13.53 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.298 1.039 . . . . 0.0 111.841 169.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.14 -171.98 2.94 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.407 -175.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.8 t -135.66 126.21 26.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.42 0.288 . . . . 0.0 110.481 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.3 t -77.53 132.93 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.438 ' O ' HG13 ' A' ' 62' ' ' ILE . 20.5 t70 -71.81 143.72 49.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.04 0.536 . . . . 0.0 110.52 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.7 -41.64 82.12 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.888 0.875 . . . . 0.0 112.1 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -75.56 1.4 14.42 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.918 0.887 . . . . 0.0 112.516 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.92 -11.09 8.99 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.696 0.398 . . . . 0.0 111.43 172.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 58' ' ' ASP . 50.9 mt -82.37 113.86 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.7 t -136.09 175.15 9.87 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.869 0.868 . . . . 0.0 109.216 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.69 76.5 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 170.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -64.89 -21.36 66.8 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.59 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.426 HG23 HD11 ' A' ' 73' ' ' LEU . 58.3 m -68.11 -36.74 80.24 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.848 0.459 . . . . 0.0 110.356 177.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.546 ' HA ' HD23 ' A' ' 73' ' ' LEU . 87.2 m-85 -95.67 16.63 16.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.978 0.511 . . . . 0.0 112.305 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -61.88 -46.67 88.38 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.227 0.33 . . . . 0.0 110.88 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.0 p -139.48 163.44 32.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.958 0.903 . . . . 0.0 110.407 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.4 tp -64.93 -31.01 72.04 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.581 0.752 . . . . 0.0 110.909 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.67 -29.54 69.49 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.716 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.0 m -64.1 -52.94 56.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.996 0.519 . . . . 0.0 110.3 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.546 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -59.3 -45.36 91.49 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 123.316 0.385 . . . . 0.0 110.811 177.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.37 87.06 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.195 0.934 . . . . 0.0 111.094 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -61.05 -53.46 56.92 Favored 'General case' 0 C--N 1.352 0.674 0 O-C-N 123.744 0.652 . . . . 0.0 109.809 178.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.475 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.2 m-85 -55.29 -52.65 62.75 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.152 0.908 . . . . 0.0 111.586 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.4 m -65.27 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 123.355 0.409 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.34 -18.65 59.94 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.607 0.363 . . . . 0.0 111.731 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -80.29 -37.86 31.91 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.314 0.506 . . . . 0.0 109.662 171.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.6 mmmt -62.57 -58.32 7.99 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.095 0.958 . . . . 0.0 111.765 -176.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.02 -14.91 62.51 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.105 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 122.932 0.493 . . . . 0.0 111.624 176.572 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.106 0.479 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -96.09 -55.04 3.09 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -70.85 -10.17 59.04 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.226 -1.352 . . . . 0.0 114.125 -165.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.0 -34.64 43.63 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.64 -34.87 67.6 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 120.825 0.345 . . . . 0.0 110.487 -175.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.71 -30.6 56.74 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.63 0.772 . . . . 0.0 110.71 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 95.5 t -67.02 -47.93 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -72.64 -26.0 61.49 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 122.662 0.385 . . . . 0.0 110.717 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.454 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.7 t30 -62.25 -47.55 83.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.158 0.583 . . . . 0.0 109.577 171.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.86 -47.44 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.979 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.63 -38.83 89.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.237 0.615 . . . . 0.0 110.534 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.55 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.84 -19.69 78.3 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.815 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -84.28 -52.06 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.404 0.682 . . . . 0.0 110.975 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.5 t -69.72 -49.28 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.906 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 41' ' ' ALA . 1.7 mm? -90.89 -6.51 54.07 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.144 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 64.61 65.62 0.63 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.126 0.97 . . . . 0.0 111.298 174.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.55 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 8.8 mp -85.75 -38.81 17.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.62 0.768 . . . . 0.0 110.799 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.68 -90.38 0.56 Allowed Glycine 0 C--N 1.35 1.322 0 O-C-N 123.31 0.381 . . . . 0.0 112.652 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.31 -19.92 16.81 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.903 0.881 . . . . 0.0 110.454 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.448 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -64.87 -31.95 73.43 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.459 0.704 . . . . 0.0 109.801 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.8 pttt -68.97 -32.88 72.78 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.793 0.437 . . . . 0.0 110.765 174.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -79.84 -29.75 40.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.171 0.589 . . . . 0.0 110.659 -173.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 t -81.63 -16.28 51.95 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.943 -177.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 pp -95.54 155.92 16.54 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.72 0.295 . . . . 0.0 110.867 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.5 p -117.65 -172.35 2.22 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.263 1.025 . . . . 0.0 111.086 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.21 75.39 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.345 0.658 . . . . 0.0 111.779 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -80.19 3.84 19.41 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.546 0.738 . . . . 0.0 112.266 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.2 t -75.38 136.65 40.77 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.691 0.396 . . . . 0.0 110.408 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.03 147.57 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.7 mt -108.26 -67.78 0.95 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 122.243 -0.286 . . . . 0.0 110.365 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.4 mt -56.73 116.33 3.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.812 0.445 . . . . 0.0 111.07 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.66 -23.43 19.64 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-N 115.331 -0.849 . . . . 0.0 113.807 176.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -77.2 -55.85 5.07 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 170.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 24.8 mm -76.52 118.08 69.04 Favored Pre-proline 0 C--O 1.241 0.634 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 176.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.48 -4.38 14.96 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.541 2.161 . . . . 0.0 112.517 -173.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 46.7 mm-40 -105.98 -15.85 14.79 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.972 0.909 . . . . 0.0 111.157 -175.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.0 tp -80.36 87.98 5.59 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 110.112 -175.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -99.62 -171.02 1.98 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.934 0.893 . . . . 0.0 111.201 174.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.53 ' O ' HG21 ' A' ' 42' ' ' VAL . 78.0 p -66.12 -53.05 42.69 Favored 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.454 1.101 . . . . 0.0 112.096 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -59.64 -30.52 68.79 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.709 0.766 . . . . 0.0 110.578 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.574 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -69.14 -26.91 65.12 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.634 174.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.53 HG21 ' O ' ' A' ' 39' ' ' SER . 2.2 m -65.8 -38.34 81.99 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.5 t -62.61 -47.05 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 CA-C-O 121.259 0.552 . . . . 0.0 110.041 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.67 -51.47 68.65 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.797 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.6 m -68.26 -35.91 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.401 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.546 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -62.31 -45.77 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.49 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 54.3 m -57.87 -46.14 85.3 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 124.064 0.853 . . . . 0.0 110.595 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.0 -37.08 86.12 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -57.89 -50.67 72.54 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.236 0.614 . . . . 0.0 109.661 172.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.8 mm-40 -50.55 -51.21 50.02 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.61 1.164 . . . . 0.0 110.78 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 47' ' ' THR . 12.5 mm-40 -65.58 -53.49 41.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.454 -174.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -65.66 -46.24 79.91 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.486 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 2.9 m-85 -91.52 -13.8 31.48 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.628 -175.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 65.65 39.96 4.66 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.448 1.099 . . . . 0.0 111.418 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -131.94 179.36 6.13 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.686 0.794 . . . . 0.0 110.085 -177.108 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.9 t -130.53 112.22 12.99 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.988 0.18 . . . . 0.0 111.25 175.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.485 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.3 t -70.36 114.08 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.492 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.5 t70 -69.03 147.24 51.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 -168.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.041 0.536 . . . . 0.0 112.408 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.92 -7.97 39.9 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.788 0.835 . . . . 0.0 113.233 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -115.02 -11.66 12.09 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.987 0.515 . . . . 0.0 111.825 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 58' ' ' ASP . 51.9 mt -88.51 125.51 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 120.737 0.303 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.7 t -143.49 176.95 8.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.784 1.234 . . . . 0.0 108.948 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.99 -32.16 73.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.692 0.758 . . . . 0.0 109.38 167.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -69.2 -16.31 63.58 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 114.598 -1.183 . . . . 0.0 111.485 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 88.5 m -74.85 -39.2 61.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.405 0.682 . . . . 0.0 109.699 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.517 ' HA ' HD22 ' A' ' 73' ' ' LEU . 96.4 m-85 -93.96 17.29 12.52 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.848 0.859 . . . . 0.0 112.751 -176.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.08 -46.58 83.66 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 122.135 0.174 . . . . 0.0 110.688 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.1 p -138.35 161.11 37.77 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.44 0.696 . . . . 0.0 111.301 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.6 tp -57.75 -42.66 84.4 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.0 0.92 . . . . 0.0 110.816 175.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.62 -31.08 78.67 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.497 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -63.09 -53.59 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.968 0.507 . . . . 0.0 110.401 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.517 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.9 mm? -57.57 -42.58 83.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.4 0.438 . . . . 0.0 110.119 177.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.552 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.45 -42.45 98.79 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.43 -177.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -48.29 78.26 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.098 0.559 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.525 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 37.2 m-85 -53.59 -54.6 35.27 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 123.733 0.646 . . . . 0.0 110.26 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.51 -25.85 34.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.109 0.563 . . . . 0.0 112.372 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 62.8 mm-40 -56.97 -51.45 69.17 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 169.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -67.3 -30.36 70.19 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.835 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.7 mmmt -64.63 -56.88 11.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.613 0.765 . . . . 0.0 112.226 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.2 -13.37 62.37 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.333 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 122.859 0.463 . . . . 0.0 110.638 169.884 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.861 0.362 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.23 -37.55 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.267 1.027 . . . . 0.0 110.467 177.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -70.96 -22.01 62.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -168.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -51.9 -31.74 29.65 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.032 0.933 . . . . 0.0 113.138 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -75.12 -40.31 59.94 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 122.87 0.468 . . . . 0.0 111.25 -175.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.65 -28.61 64.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.992 0.517 . . . . 0.0 111.03 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.468 HG22 HD11 ' A' ' 49' ' ' LEU . 90.0 t -66.9 -49.24 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 41.8 ptt180 -71.03 -25.12 62.52 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.2 t30 -61.85 -49.32 76.76 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 123.335 0.654 . . . . 0.0 109.318 173.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.0 mt -60.54 -51.44 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.633 177.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.9 -34.24 77.69 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.224 0.21 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.567 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -72.4 -21.46 79.4 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-O 120.196 -0.224 . . . . 0.0 113.262 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.02 -57.14 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.4 0.68 . . . . 0.0 110.176 176.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 97.1 t -71.11 -47.38 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.741 1.216 . . . . 0.0 110.534 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.404 HD13 HD13 ' A' ' 37' ' ' LEU . 44.1 mt -83.46 -6.5 59.47 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.553 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 63.41 59.91 1.19 Allowed 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.58 1.152 . . . . 0.0 110.916 172.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.567 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.7 mp -89.65 -29.61 18.69 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.45 173.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.0 -89.88 0.21 Allowed Glycine 0 C--N 1.351 1.406 0 O-C-N 123.978 0.799 . . . . 0.0 112.31 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -101.17 -18.94 15.95 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.928 0.891 . . . . 0.0 110.857 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.86 -26.93 69.01 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.233 0.613 . . . . 0.0 111.095 -177.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.1 pttt -62.87 -34.91 78.36 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 123.246 0.618 . . . . 0.0 111.313 173.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -69.7 -29.1 66.43 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.386 1.074 . . . . 0.0 110.995 -176.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -93.26 -6.57 47.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -174.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -99.34 153.53 18.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 176.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.2 p -112.9 -176.07 2.81 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 111.184 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.95 -50.24 74.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.796 0.838 . . . . 0.0 110.668 173.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.1 m -71.54 -12.48 61.39 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.205 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -69.75 140.93 53.5 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 123.311 0.644 . . . . 0.0 110.168 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 63.6 t -79.37 152.21 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.364 1.066 . . . . 0.0 109.848 -176.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.28 -65.74 1.16 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.437 0.695 . . . . 0.0 109.862 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.1 mt -60.56 111.71 1.7 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.05 0.452 . . . . 0.0 110.703 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 103.03 -30.53 10.23 Favored Glycine 0 C--N 1.333 0.416 0 CA-C-N 115.061 -0.972 . . . . 0.0 112.79 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -79.54 -53.61 6.7 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.005 0.431 . . . . 0.0 110.058 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 26.8 mm -87.29 120.82 71.45 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.72 -14.83 33.36 Favored 'Trans proline' 0 C--N 1.372 1.765 0 C-N-CA 122.39 2.06 . . . . 0.0 112.22 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -85.83 -18.23 33.47 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 -174.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.404 HD13 HD13 ' A' ' 15' ' ' LEU . 40.2 tp -83.28 80.18 9.16 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 122.036 0.922 . . . . 0.0 110.272 -175.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -93.8 177.31 6.04 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.976 1.71 . . . . 0.0 109.681 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.589 ' O ' HG23 ' A' ' 42' ' ' VAL . 3.6 m -44.34 -64.11 0.75 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.827 1.251 . . . . 0.0 113.35 170.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.8 mmt -65.92 -26.83 67.78 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 121.512 -0.742 . . . . 0.0 111.236 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.18 -38.32 87.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.286 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 39' ' ' SER . 15.1 m -67.07 -35.06 73.52 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 176.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 t -62.17 -48.49 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 121.688 0.756 . . . . 0.0 110.177 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -59.62 -46.36 89.2 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 113.656 -1.611 . . . . 0.0 112.475 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.7 m -73.67 -30.86 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.127 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.426 HD11 HD12 ' A' ' 62' ' ' ILE . 96.4 mt -63.41 -48.77 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.7 m -55.84 -47.01 77.99 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.421 1.076 . . . . 0.0 110.153 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 -40.67 97.3 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.864 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.468 HD11 HG22 ' A' ' 7' ' ' VAL . 2.1 mm? -56.16 -49.91 72.63 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.284 0.564 . . . . 0.0 109.858 175.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -63.53 -38.67 92.0 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.594 -1.185 . . . . 0.0 112.249 -178.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -66.77 -54.57 21.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.406 0.682 . . . . 0.0 111.072 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -57.63 -57.6 12.01 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.788 0.835 . . . . 0.0 111.325 -177.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -82.55 -15.01 53.9 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.204 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 64.0 58.84 1.15 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.854 0.862 . . . . 0.0 111.427 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.438 ' CE2' HG23 ' A' ' 57' ' ' VAL . 8.9 p90 -142.95 -177.69 5.46 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.311 173.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.3 m -131.0 121.19 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.882 0.473 . . . . 0.0 110.311 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.438 HG23 ' CE2' ' A' ' 55' ' ' PHE . 2.1 t -77.69 127.31 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 29.4 t70 -89.83 153.75 20.42 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 122.799 0.44 . . . . 0.0 110.651 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -58.41 -34.29 70.6 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.043 0.937 . . . . 0.0 113.223 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -59.75 -33.76 72.08 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.837 0.855 . . . . 0.0 112.156 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.0 pt-20 -97.99 -15.86 19.91 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.462 0.705 . . . . 0.0 110.822 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.426 HD12 HD11 ' A' ' 46' ' ' ILE . 38.4 mt -83.84 119.7 33.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 123.09 0.556 . . . . 0.0 111.061 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 82.9 p -155.29 -172.0 4.01 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.055 0.942 . . . . 0.0 109.378 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.48 -29.72 69.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.058 0.456 . . . . 0.0 110.38 171.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -67.94 -13.44 62.16 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.832 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.1 m -79.26 -41.47 28.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 0.0 110.105 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.455 ' HA ' HD22 ' A' ' 73' ' ' LEU . 78.6 m-85 -99.31 15.53 25.91 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.94 -49.6 76.8 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 123.055 0.222 . . . . 0.0 110.904 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 74.5 p -138.14 164.29 29.53 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.534 0.734 . . . . 0.0 110.515 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 tp -62.82 -34.5 77.44 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.205 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.02 -31.91 79.29 Favored Glycine 0 C--N 1.341 0.85 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.399 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -62.57 -53.01 61.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.164 0.586 . . . . 0.0 110.103 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.455 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.48 -41.91 81.63 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 123.357 0.41 . . . . 0.0 110.612 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.55 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.22 -44.95 92.29 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 124.048 0.843 . . . . 0.0 110.891 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.84 -54.95 41.08 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.195 0.998 . . . . 0.0 110.118 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 66.2 m-85 -53.83 -55.87 22.7 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.013 0.82 . . . . 0.0 110.753 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 19.6 m -66.48 -25.98 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 79.3 mm-40 -59.17 -52.67 64.7 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -60.8 -38.99 87.23 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.102 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -67.93 -52.43 36.23 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.598 0.759 . . . . 0.0 111.606 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.37 -17.96 62.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.989 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 CA--C 1.547 0.839 0 C-N-CA 122.819 0.448 . . . . 0.0 111.059 171.567 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.99 -21.52 15.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.414 0.686 . . . . 0.0 111.402 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -90.72 -14.84 31.36 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 118.209 -0.901 . . . . 0.0 113.086 -174.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.52 -28.22 43.77 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 118.785 0.721 . . . . 0.0 112.203 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 39.3 tt0 -67.97 -46.84 70.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.764 0.825 . . . . 0.0 110.601 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.61 70.43 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.426 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 89.2 t -66.26 -48.38 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 122.864 0.465 . . . . 0.0 109.788 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 5' ' ' GLU . 37.1 ptt180 -69.08 -26.76 65.1 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 123.533 0.521 . . . . 0.0 110.144 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -61.42 -51.39 68.92 Favored 'General case' 0 C--N 1.351 0.644 0 C-N-CA 123.532 0.733 . . . . 0.0 109.506 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.5 mt -62.73 -49.12 84.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.105 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.84 -45.9 87.44 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.06 0.544 . . . . 0.0 111.047 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.469 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -69.93 -18.42 74.4 Favored Glycine 0 C--N 1.337 0.605 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.442 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -81.14 -53.22 6.57 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 117.293 0.546 . . . . 0.0 110.228 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.65 -49.8 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 124.066 0.946 . . . . 0.0 111.141 -173.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.493 HD12 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -82.76 -7.4 59.66 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.892 0.477 . . . . 0.0 111.159 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 t30 62.23 64.03 1.01 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.668 1.187 . . . . 0.0 111.644 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 9.6 mp -88.66 -31.43 18.52 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.91 170.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.93 -99.62 0.5 Allowed Glycine 0 C--N 1.352 1.431 0 O-C-N 123.552 0.533 . . . . 0.0 113.617 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.15 -23.18 35.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.056 0.943 . . . . 0.0 110.689 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.554 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.56 -30.21 69.78 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 122.944 0.498 . . . . 0.0 111.234 -175.384 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.469 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.1 pttt -65.15 -26.21 68.08 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 120.689 0.281 . . . . 0.0 111.341 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -79.5 -33.74 41.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.265 0.626 . . . . 0.0 110.691 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 t -83.2 -8.59 59.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -173.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.4 pp -96.23 166.78 11.57 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 120.969 0.414 . . . . 0.0 110.524 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 73.3 p -115.1 -178.91 3.48 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.113 0.965 . . . . 0.0 110.335 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.89 -14.94 57.46 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.139 0.576 . . . . 0.0 112.209 174.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.4 t -90.9 8.25 35.99 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.045 0.538 . . . . 0.0 111.587 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 94.1 p -78.87 121.2 24.54 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.62 0.368 . . . . 0.0 110.15 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.02 145.71 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.449 ' HA ' HG12 ' A' ' 34' ' ' ILE . 55.2 mt -101.69 -70.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.6 mt -57.94 114.95 2.56 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 122.954 0.501 . . . . 0.0 111.393 178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.05 -38.1 3.22 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.121 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -75.92 -51.99 11.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.906 0.482 . . . . 0.0 109.913 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 30' ' ' LEU . 19.6 mm -79.08 112.23 26.24 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 175.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.34 2.27 8.62 Favored 'Trans proline' 0 C--N 1.369 1.652 0 C-N-CA 122.764 2.309 . . . . 0.0 112.113 -177.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 23.4 mm-40 -97.12 -19.41 18.69 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 123.802 0.841 . . . . 0.0 109.688 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.34 96.86 6.79 Favored 'General case' 0 C--N 1.352 0.697 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -90.77 173.87 7.78 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.801 1.24 . . . . 0.0 109.615 172.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.598 ' O ' HG23 ' A' ' 42' ' ' VAL . 86.6 p -59.21 -49.13 79.01 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.508 0.723 . . . . 0.0 111.081 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.3 mmt -60.51 -31.19 70.26 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.9 -0.5 . . . . 0.0 110.724 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.493 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -69.57 -29.01 66.48 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.346 176.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 39' ' ' SER . 2.3 m -63.8 -37.2 79.09 Favored 'Isoleucine or valine' 0 C--N 1.372 1.584 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 t -66.92 -47.46 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.174 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.59 -42.78 88.84 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.031 -1.441 . . . . 0.0 112.173 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -75.7 -31.01 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.654 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.8 mt -59.79 -54.43 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 172.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 37.7 m -51.37 -49.2 61.96 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 124.673 1.233 . . . . 0.0 110.868 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.78 -43.78 98.18 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.014 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -55.59 -47.97 75.61 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.144 0.578 . . . . 0.0 110.333 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -59.4 -43.83 92.91 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.983 0.913 . . . . 0.0 111.241 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 47' ' ' THR . 33.2 mm-40 -65.12 -59.12 4.46 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.597 0.759 . . . . 0.0 111.097 -177.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -67.34 -44.85 78.06 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.554 0.741 . . . . 0.0 112.288 -171.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -82.56 -21.14 35.42 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 119.402 -0.332 . . . . 0.0 111.309 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.7 t70 64.03 64.1 0.77 Allowed 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.261 1.024 . . . . 0.0 110.615 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.02 -174.3 4.93 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.7 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -130.49 119.96 23.41 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.217 0.607 . . . . 0.0 110.698 170.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.2 t -70.72 126.37 30.84 Favored 'Isoleucine or valine' 0 C--N 1.353 0.755 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 165.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.47 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.3 t70 -73.54 144.57 46.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 122.564 0.346 . . . . 0.0 110.848 -174.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -51.16 -42.66 60.95 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.067 0.947 . . . . 0.0 112.973 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.83 -19.91 63.45 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.798 0.839 . . . . 0.0 112.701 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.2 pt-20 -102.55 -7.4 21.88 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.82 0.448 . . . . 0.0 111.15 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 58' ' ' ASP . 75.4 mt -85.81 105.39 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.7 t -133.16 170.57 15.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.016 0.926 . . . . 0.0 109.599 174.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.72 -32.11 71.38 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.472 0.654 . . . . 0.0 109.996 170.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.74 -12.58 61.38 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.599 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.438 HG23 HD13 ' A' ' 73' ' ' LEU . 42.1 m -74.72 -42.18 58.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.543 ' HA ' HD22 ' A' ' 73' ' ' LEU . 92.2 m-85 -92.72 20.94 5.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.096 0.958 . . . . 0.0 112.31 -176.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.45 ' HG3' HG22 ' A' ' 69' ' ' THR . 7.6 pt-20 -65.14 -45.21 85.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.292 0.237 . . . . 0.0 110.633 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.45 HG22 ' HG3' ' A' ' 68' ' ' GLU . 11.5 t -150.13 158.53 44.25 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.064 0.546 . . . . 0.0 110.873 -179.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 tp -52.33 -40.34 61.8 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.547 1.139 . . . . 0.0 111.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.96 -41.82 96.52 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 114.607 -1.179 . . . . 0.0 111.794 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.42 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 50.5 m -60.1 -50.29 74.3 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.001 0.52 . . . . 0.0 111.035 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.543 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -58.06 -40.17 80.31 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 122.604 0.361 . . . . 0.0 110.395 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.547 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.92 -48.64 80.9 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.308 1.005 . . . . 0.0 110.632 178.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.12 -45.59 87.03 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 124.042 0.937 . . . . 0.0 111.002 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.475 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.5 m-85 -56.71 -57.35 12.79 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.294 177.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.7 m -67.6 -23.11 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.3 mm-40 -57.39 -51.28 70.06 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.48 -51.84 63.88 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.312 -176.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.57 -48.49 79.21 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 0.0 112.451 -171.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -78.1 -16.72 57.74 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.155 -178.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 122.82 0.448 . . . . 0.0 111.493 172.231 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 121.437 0.637 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . 0.415 ' HA ' HE21 ' A' ' 2' ' ' GLN . 0.0 OUTLIER -95.1 -46.59 6.73 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.152 171.279 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -74.83 -17.72 60.56 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 113.549 -1.659 . . . . 0.0 113.507 -164.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.24 -37.72 37.06 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.991 0.916 . . . . 0.0 112.487 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -75.17 -41.1 58.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.712 -174.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.54 66.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.367 0.667 . . . . 0.0 111.414 174.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.7 t -70.46 -50.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.082 0.553 . . . . 0.0 109.536 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -67.08 -27.41 67.34 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.32 -58.56 6.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.011 0.924 . . . . 0.0 109.727 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.3 mt -61.28 -49.77 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.951 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.12 -41.78 89.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.308 0.643 . . . . 0.0 111.126 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.61 -19.99 79.69 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 121.556 -0.354 . . . . 0.0 113.42 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -75.73 -48.64 21.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.949 0.5 . . . . 0.0 110.446 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.47 -48.63 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 123.523 0.729 . . . . 0.0 110.38 -177.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.496 ' HB2' HD11 ' A' ' 17' ' ' LEU . 44.2 mt -84.5 0.04 51.25 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.227 -177.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 66.76 24.84 9.83 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.366 1.066 . . . . 0.0 111.507 170.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.496 HD11 ' HB2' ' A' ' 15' ' ' LEU . 9.6 mp -60.11 -41.31 92.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.222 0.609 . . . . 0.0 110.706 174.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.16 -81.68 0.03 OUTLIER Glycine 0 C--N 1.354 1.546 0 O-C-N 124.196 0.935 . . . . 0.0 114.089 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -87.47 -35.83 18.02 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.026 0.93 . . . . 0.0 110.252 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.09 -28.29 69.98 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.123 0.969 . . . . 0.0 110.904 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.494 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 54.9 pttt -70.33 -31.99 69.53 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.806 0.442 . . . . 0.0 111.864 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -80.02 -31.5 39.6 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.102 0.561 . . . . 0.0 110.726 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.1 t -85.65 -5.88 59.21 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.207 0.603 . . . . 0.0 112.45 -175.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -98.07 155.99 16.87 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.236 0.471 . . . . 0.0 110.084 176.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.8 p -112.94 -175.64 2.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.619 0.767 . . . . 0.0 110.921 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -35.77 76.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.273 0.629 . . . . 0.0 110.944 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.6 m -75.95 -15.8 60.11 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.368 -0.833 . . . . 0.0 112.242 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.9 p -67.82 140.63 56.61 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.859 0.299 . . . . 0.0 110.825 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -84.26 143.06 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 123.782 0.833 . . . . 0.0 109.341 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HA ' HG12 ' A' ' 34' ' ' ILE . 49.2 mt -110.35 -70.27 0.82 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.828 0.451 . . . . 0.0 109.873 178.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.01 112.52 1.22 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.393 1.077 . . . . 0.0 110.699 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 -40.47 2.48 Favored Glycine 0 C--N 1.345 1.081 0 O-C-N 123.541 0.526 . . . . 0.0 112.745 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -78.14 -59.07 2.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.262 0.625 . . . . 0.0 110.475 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 30' ' ' LEU . 31.9 mm -76.26 120.28 80.96 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.32 -13.38 35.69 Favored 'Trans proline' 0 C--N 1.37 1.699 0 C-N-CA 122.726 2.284 . . . . 0.0 112.441 -177.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -86.75 -13.92 43.87 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.53 0.732 . . . . 0.0 111.27 -177.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.41 81.7 5.64 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -96.04 170.88 8.97 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.65 1.58 . . . . 0.0 109.92 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.605 ' O ' HG22 ' A' ' 42' ' ' VAL . 6.1 m -46.56 -67.81 0.25 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.712 1.205 . . . . 0.0 113.019 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.0 mmm -66.13 -24.07 66.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.801 -0.562 . . . . 0.0 111.501 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.42 -37.06 85.82 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 124.069 0.856 . . . . 0.0 112.251 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.605 HG22 ' O ' ' A' ' 39' ' ' SER . 7.7 m -68.7 -37.61 77.77 Favored 'Isoleucine or valine' 0 C--N 1.367 1.347 0 CA-C-N 118.445 0.566 . . . . 0.0 109.776 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -61.18 -45.29 98.88 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.592 0.711 . . . . 0.0 109.374 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.4 -50.14 74.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 113.605 -1.634 . . . . 0.0 113.085 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.41 HG23 ' HA ' ' A' ' 42' ' ' VAL . 26.7 m -71.82 -30.51 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.619 -176.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -63.48 -50.59 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.3 m -53.24 -48.68 68.01 Favored 'General case' 0 C--N 1.351 0.656 0 O-C-N 124.421 1.076 . . . . 0.0 110.929 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.41 -43.74 98.1 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.115 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -57.13 -46.5 82.63 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.463 0.705 . . . . 0.0 110.59 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.88 -44.64 91.16 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.034 0.934 . . . . 0.0 111.222 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 47' ' ' THR . 37.6 mm-40 -59.31 -61.34 2.7 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.63 0.772 . . . . 0.0 111.353 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -67.3 -51.56 51.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.874 -171.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 m-30 -75.2 -16.26 60.5 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.522 0.329 . . . . 0.0 111.551 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.0 t70 68.12 66.73 0.34 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.268 1.027 . . . . 0.0 110.63 175.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.423 ' CE2' HG23 ' A' ' 57' ' ' VAL . 7.7 p90 -157.01 -170.28 3.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.015 172.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.88 138.66 45.71 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 167.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.423 HG23 ' CE2' ' A' ' 55' ' ' PHE . 2.9 t -89.69 122.69 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 176.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.411 ' O ' HG13 ' A' ' 62' ' ' ILE . 18.0 t70 -87.93 153.79 21.02 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.674 0.79 . . . . 0.0 111.281 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.67 -36.9 67.61 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.548 1.139 . . . . 0.0 112.365 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.35 -33.55 76.23 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.228 1.011 . . . . 0.0 111.844 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -96.87 -20.68 17.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.941 0.496 . . . . 0.0 110.918 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 58' ' ' ASP . 53.7 mt -74.76 124.51 32.61 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 174.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.5 t -146.13 -178.7 6.27 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.39 1.076 . . . . 0.0 108.474 165.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.41 74.06 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.401 0.619 . . . . 0.0 109.574 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -65.94 -12.28 53.63 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.837 178.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.411 HG22 HD11 ' A' ' 73' ' ' LEU . 91.6 m -72.9 -38.17 67.0 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.009 0.523 . . . . 0.0 110.489 174.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.487 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.6 m-85 -97.75 7.05 47.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.16 -47.85 77.44 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.376 0.422 . . . . 0.0 111.232 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.6 p -135.8 166.33 23.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.964 0.506 . . . . 0.0 110.868 173.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.9 tp -59.57 -38.05 80.11 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.072 174.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.1 -35.08 90.96 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.87 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -62.28 -53.08 60.32 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.012 0.525 . . . . 0.0 110.574 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -56.43 -43.48 79.46 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.508 0.505 . . . . 0.0 110.071 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.92 -48.13 82.57 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 124.589 1.18 . . . . 0.0 111.667 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -66.96 -39.03 87.15 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.423 0.452 . . . . 0.0 110.94 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.491 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 24.5 m-85 -57.68 -54.72 43.66 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 176.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.44 -24.38 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.099 0.56 . . . . 0.0 112.051 -178.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.6 mm-40 -57.47 -56.01 27.42 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -60.19 -34.94 74.32 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.546 -174.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 30.9 mmmt -63.85 -56.71 13.33 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.344 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.437 HD22 ' HB2' ' A' ' 80' ' ' LYS . 3.1 mm? -84.22 -13.26 53.15 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -173.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -175.151 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.438 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.11 -36.22 9.76 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.035 0.934 . . . . 0.0 110.799 177.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.83 -17.57 61.05 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -169.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -51.99 -33.04 36.42 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 123.809 0.844 . . . . 0.0 112.581 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 -41.78 63.96 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.205 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.5 -28.95 65.36 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.917 0.487 . . . . 0.0 111.053 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.403 HG12 ' HB2' ' A' ' 73' ' ' LEU . 78.3 t -67.54 -50.55 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 122.994 0.517 . . . . 0.0 109.927 176.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -67.52 -28.62 67.97 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -60.26 -52.89 63.37 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 123.966 0.791 . . . . 0.0 109.749 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.419 HG23 HD21 ' A' ' 49' ' ' LEU . 85.7 mt -62.92 -55.33 24.3 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 O-C-N 124.219 0.949 . . . . 0.0 111.492 -178.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.64 -34.65 78.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.742 0.417 . . . . 0.0 111.495 -175.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.456 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -78.91 -20.05 71.46 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-O 119.989 -0.34 . . . . 0.0 113.689 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.18 -48.01 25.63 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.033 0.533 . . . . 0.0 109.705 173.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.429 HG12 ' ND2' ' A' ' 44' ' ' ASN . 71.2 t -70.17 -49.77 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.466 1.106 . . . . 0.0 110.929 -176.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -78.21 -9.26 59.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.427 0.691 . . . . 0.0 111.255 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 67.02 44.52 1.94 Allowed 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.543 1.137 . . . . 0.0 111.401 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 7.0 mp -72.29 -35.36 68.66 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.54 1.136 . . . . 0.0 110.68 173.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.24 -91.39 0.37 Allowed Glycine 0 C--N 1.346 1.122 0 CA-C-N 115.727 -0.67 . . . . 0.0 113.494 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -97.06 -21.02 17.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.787 0.835 . . . . 0.0 110.754 -177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.467 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -61.9 -34.25 75.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.392 0.677 . . . . 0.0 109.893 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 56.9 pttt -68.78 -29.84 68.3 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.224 0.61 . . . . 0.0 111.579 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -75.8 -40.74 54.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.164 0.586 . . . . 0.0 110.313 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -85.87 13.32 7.57 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.215 0.606 . . . . 0.0 112.05 -173.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.42 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.6 pp -113.36 163.09 15.29 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 122.011 -0.431 . . . . 0.0 111.206 172.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.9 p -122.81 -173.17 2.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.478 1.111 . . . . 0.0 110.251 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.03 65.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.316 0.646 . . . . 0.0 112.719 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -86.79 0.48 54.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.198 0.599 . . . . 0.0 112.602 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.42 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 97.2 p -73.26 125.68 28.34 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.588 0.355 . . . . 0.0 110.751 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.0 t -76.83 136.22 25.02 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.478 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.3 mt -108.6 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.532 0.333 . . . . 0.0 110.229 -175.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.52 117.02 5.64 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.45 -33.12 6.26 Favored Glycine 0 C--N 1.342 0.91 0 CA-C-N 115.855 -0.612 . . . . 0.0 113.151 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -90.54 -44.73 9.38 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.084 0.554 . . . . 0.0 110.983 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.478 HG12 ' HA ' ' A' ' 30' ' ' LEU . 33.7 mm -79.87 120.3 79.46 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -70.72 -13.77 32.54 Favored 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 122.847 2.364 . . . . 0.0 112.927 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -94.11 -11.65 30.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.363 0.665 . . . . 0.0 111.091 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -82.66 88.9 6.69 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -101.63 174.03 6.15 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.309 1.443 . . . . 0.0 108.932 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.572 ' O ' HG21 ' A' ' 42' ' ' VAL . 6.2 m -44.78 -65.33 0.54 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.796 1.238 . . . . 0.0 113.45 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.7 mmm -71.31 -16.68 62.46 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.606 -0.684 . . . . 0.0 111.654 -175.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.82 -33.85 71.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.319 0.648 . . . . 0.0 111.539 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.572 HG21 ' O ' ' A' ' 39' ' ' SER . 2.7 m -68.19 -39.4 81.14 Favored 'Isoleucine or valine' 0 C--N 1.371 1.507 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.9 t -64.85 -43.32 96.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.534 0.683 . . . . 0.0 109.904 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.429 ' ND2' HG12 ' A' ' 14' ' ' VAL . 56.3 t30 -66.02 -39.55 90.32 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.91 -1.496 . . . . 0.0 112.287 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 m -70.38 -39.59 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.036 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 42' ' ' VAL . 92.9 mt -61.4 -43.1 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 CA-C-N 118.257 0.48 . . . . 0.0 110.045 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 87.8 m -58.86 -45.13 90.84 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.108 175.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -63.07 -36.75 84.63 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.642 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.419 HD21 HG23 ' A' ' 10' ' ' ILE . 3.5 mm? -60.35 -40.08 89.45 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.496 0.718 . . . . 0.0 110.103 175.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -57.98 -51.02 71.39 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.005 0.816 . . . . 0.0 110.481 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 47' ' ' THR . 7.5 mm-40 -58.62 -45.1 89.95 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 124.161 0.913 . . . . 0.0 111.473 -173.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 17.3 m-85 -81.74 -55.98 4.28 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -172.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -83.82 -18.19 38.47 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.0 58.88 2.58 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.339 1.056 . . . . 0.0 111.384 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -129.29 -171.82 2.59 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.431 172.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.1 m -127.8 111.72 13.96 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.628 166.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.1 t -69.47 112.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.358 0.949 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 173.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 32.9 t70 -77.54 151.71 34.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.179 0.592 . . . . 0.0 111.217 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -60.16 -32.94 71.52 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.604 0.761 . . . . 0.0 112.433 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -71.48 -31.85 67.6 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.296 0.638 . . . . 0.0 111.823 -173.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -85.65 -20.54 29.28 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.744 0.418 . . . . 0.0 110.887 -178.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 68.1 mt -73.07 124.06 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.26 0.624 . . . . 0.0 111.039 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 86.2 p -147.91 175.99 10.52 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.193 0.997 . . . . 0.0 109.448 166.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.14 78.84 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.636 0.731 . . . . 0.0 110.194 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -78.75 -8.63 58.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.114 -176.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -70.71 -37.63 73.57 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.554 ' HA ' HD21 ' A' ' 73' ' ' LEU . 55.2 m-85 -97.58 14.71 25.67 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.406 0.682 . . . . 0.0 112.72 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.69 -44.19 96.87 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 0.0 111.0 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.3 t -144.94 162.21 37.44 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.252 0.621 . . . . 0.0 110.428 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.77 -36.85 77.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.106 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.23 -33.86 87.31 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.96 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 74.4 m -64.67 -53.51 46.31 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 122.89 0.476 . . . . 0.0 110.662 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.554 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -59.01 -39.04 80.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.021 0.201 . . . . 0.0 110.477 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.556 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.03 -45.49 86.86 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 124.073 0.858 . . . . 0.0 110.383 176.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.76 -49.76 76.45 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.957 0.903 . . . . 0.0 110.893 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.448 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 72.9 m-85 -61.59 -48.14 82.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.596 0.358 . . . . 0.0 111.037 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 18.2 m -70.17 -26.79 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.512 0.325 . . . . 0.0 111.627 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 77.6 mm-40 -59.37 -51.86 68.11 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -58.69 -37.6 76.43 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 124.097 0.873 . . . . 0.0 112.052 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.0 mmmt -59.76 -54.96 40.17 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.254 0.55 . . . . 0.0 110.853 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.07 -14.01 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.895 -176.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.479 0.982 0 C-N-CA 122.678 0.391 . . . . 0.0 111.567 175.528 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.32 -41.77 8.09 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.135 0.969 . . . . 0.0 108.432 178.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -82.77 -3.91 57.24 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 113.691 -1.595 . . . . 0.0 112.734 -168.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -52.14 -34.32 44.12 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.941 0.897 . . . . 0.0 112.434 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 8' ' ' ARG . 41.7 tt0 -72.79 -43.21 63.04 Favored 'General case' 0 C--N 1.352 0.686 0 O-C-N 123.579 0.549 . . . . 0.0 110.355 -176.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.62 -31.96 73.27 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.571 0.348 . . . . 0.0 111.124 176.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 85.1 t -68.53 -46.51 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 122.821 0.448 . . . . 0.0 110.461 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HG2' ' HA ' ' A' ' 5' ' ' GLU . 38.9 ptt180 -70.79 -23.12 62.33 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.673 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -63.95 -50.19 69.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.458 HG23 HD23 ' A' ' 49' ' ' LEU . 88.7 mt -61.39 -48.3 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.673 178.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.05 -36.81 85.53 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.052 0.541 . . . . 0.0 110.341 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.516 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.45 -21.05 78.69 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.54 -0.755 . . . . 0.0 113.67 175.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -85.85 -46.01 11.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.952 0.901 . . . . 0.0 111.225 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.7 t -76.86 -55.73 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 123.752 0.821 . . . . 0.0 110.385 -175.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.517 HD12 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -82.93 -9.52 59.26 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.858 -176.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 68.28 63.52 0.36 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.735 1.214 . . . . 0.0 110.796 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.516 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.0 mp -82.01 -36.93 27.3 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.586 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.94 -89.66 0.06 OUTLIER Glycine 0 C--N 1.356 1.688 0 O-C-N 123.632 0.583 . . . . 0.0 113.795 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.94 -40.57 22.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.785 0.834 . . . . 0.0 110.317 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -28.17 63.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.917 1.287 . . . . 0.0 112.298 -170.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.7 4.11 8.45 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -92.16 -46.98 7.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.91 0.484 . . . . 0.0 109.775 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 t -70.48 -29.09 65.54 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.87 -172.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 4.1 pp -84.16 157.42 21.68 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.84 0.456 . . . . 0.0 111.431 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.2 p -137.42 -162.68 1.32 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.357 1.463 . . . . 0.0 108.533 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.83 -23.07 51.04 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.8 m -77.67 -12.02 59.93 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.628 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 35.9 t -62.03 124.74 21.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.742 0.817 . . . . 0.0 111.349 -177.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 67.6 t -74.0 153.97 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 70.9 mt -120.97 -60.11 1.68 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.412 HD21 HD11 ' A' ' 37' ' ' LEU . 33.5 mt -56.73 110.94 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.142 0.577 . . . . 0.0 110.63 169.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.42 -32.56 6.13 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.269 -0.878 . . . . 0.0 113.181 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -76.86 -60.29 2.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.529 0.331 . . . . 0.0 110.18 -179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.509 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 25.1 mm -78.33 116.98 63.46 Favored Pre-proline 0 CA--C 1.542 0.659 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.15 -6.55 18.09 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.324 2.016 . . . . 0.0 112.297 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -97.9 -10.29 24.85 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.69 0.796 . . . . 0.0 111.144 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.509 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.8 tm? -79.0 82.81 5.15 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -177.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -101.79 174.34 6.0 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.417 1.487 . . . . 0.0 109.74 176.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.601 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -43.32 -60.52 1.67 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.209 1.404 . . . . 0.0 112.715 166.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.9 mmt -60.83 -32.49 71.87 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 121.135 0.493 . . . . 0.0 110.822 -178.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.517 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -68.74 -29.33 67.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.648 176.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 39' ' ' SER . 3.3 m -66.96 -37.68 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.875 0.761 . . . . 0.0 109.171 174.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 t -67.28 -44.64 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-O 121.543 0.687 . . . . 0.0 109.29 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -58.69 -49.5 77.36 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.059 -1.428 . . . . 0.0 112.532 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -70.35 -39.04 76.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.802 -175.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.513 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 89.2 mt -60.15 -46.26 94.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.449 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 88.4 m -57.0 -43.32 81.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 124.065 0.853 . . . . 0.0 110.611 174.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.405 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -69.6 -28.19 65.73 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.265 0.626 . . . . 0.0 112.15 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.508 HD12 HG11 ' A' ' 77' ' ' VAL . 3.6 mm? -61.95 -48.11 81.85 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -56.43 -42.83 78.72 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.005 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 47' ' ' THR . 47.3 mm-40 -60.17 -64.34 0.98 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.879 0.872 . . . . 0.0 111.571 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.428 ' HB2' HD13 ' A' ' 10' ' ' ILE . 48.3 m-85 -66.56 -45.78 78.24 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.838 0.711 . . . . 0.0 112.326 -171.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -83.94 -21.68 31.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 66.29 57.93 0.72 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.458 1.103 . . . . 0.0 111.025 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -140.58 179.48 6.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.157 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -126.44 114.89 18.77 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.1 p -72.48 145.77 11.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 124.944 1.298 . . . . 0.0 110.918 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.1 t70 -87.01 142.22 28.09 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 174.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.4 -36.79 74.29 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -176.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -70.19 -15.98 63.01 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.9 pt-20 -86.91 -33.43 19.72 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.647 0.379 . . . . 0.0 110.34 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 42.9 mt -78.99 129.01 38.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.006 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 t -141.76 -177.68 5.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.957 1.303 . . . . 0.0 107.961 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.73 -27.41 67.6 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -64.84 -13.41 55.99 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.371 1.068 . . . . 0.0 111.659 174.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 89.1 m -76.03 -50.25 15.31 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 170.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.454 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 97.5 m-85 -84.2 8.76 14.71 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.503 ' HG3' HG23 ' A' ' 69' ' ' THR . 10.2 pt-20 -60.04 -42.97 95.58 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 122.47 0.308 . . . . 0.0 110.907 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.503 HG23 ' HG3' ' A' ' 68' ' ' GLU . 10.0 t -150.82 162.53 40.56 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.418 0.628 . . . . 0.0 112.009 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.7 -37.78 82.82 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.506 -1.224 . . . . 0.0 110.754 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.94 -32.46 84.11 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.86 -177.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 54.9 m -70.17 -51.94 27.3 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.265 177.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.41 -46.62 62.98 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.234 0.54 . . . . 0.0 111.105 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -63.68 -39.18 93.69 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.203 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -47.34 83.02 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.953 0.901 . . . . 0.0 109.628 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 59.1 m-85 -61.78 -43.51 98.7 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.207 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.508 HG11 HD12 ' A' ' 49' ' ' LEU . 29.9 m -72.87 -23.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-O 119.007 -0.521 . . . . 0.0 112.228 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 65.0 mm-40 -56.19 -51.17 69.0 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 167.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.421 ' HB2' ' O ' ' A' ' 76' ' ' PHE . 90.6 m-70 -54.33 -49.56 69.44 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.286 0.991 . . . . 0.0 111.832 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 28.1 mmmt -68.18 -43.71 77.53 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -171.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.25 -14.9 52.24 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.699 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.486 1.37 0 C-N-CA 123.173 0.589 . . . . 0.0 112.55 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.438 ' HE2' HD21 ' A' ' 75' ' ' LEU . 2.0 tpt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -36.49 79.07 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.801 0.84 . . . . 0.0 113.026 -166.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.436 ' O ' HG21 ' A' ' 7' ' ' VAL . 2.6 m-70 -73.23 -11.56 60.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 118.187 -0.911 . . . . 0.0 112.282 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.24 -30.83 51.67 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 118.395 0.543 . . . . 0.0 110.879 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.19 -53.14 53.96 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.549 1.14 . . . . 0.0 110.528 -178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.442 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.26 -35.49 79.63 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.393 -0.822 . . . . 0.0 111.252 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -65.82 -51.74 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 O-C-N 123.433 0.458 . . . . 0.0 110.048 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.41 ' HA ' HD13 ' A' ' 11' ' ' LEU . 40.9 ptt180 -68.8 -27.0 65.48 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.041 0.536 . . . . 0.0 110.29 -176.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.6 -48.98 79.36 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 123.96 0.788 . . . . 0.0 109.657 173.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.2 mt -63.15 -47.41 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 124.274 0.984 . . . . 0.0 110.932 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 8' ' ' ARG . 52.2 mt -60.3 -42.79 96.28 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.492 0.717 . . . . 0.0 111.025 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.431 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -77.33 -18.78 77.66 Favored Glycine 0 C--N 1.339 0.72 0 CA-C-N 115.742 -0.663 . . . . 0.0 113.202 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.1 -43.31 43.9 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.225 0.512 . . . . 0.0 109.693 174.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 10' ' ' ILE . 88.1 t -71.8 -60.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -83.05 -3.8 57.65 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.621 -170.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 66.61 55.97 0.76 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.792 1.237 . . . . 0.0 111.733 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -84.11 -29.25 26.91 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.964 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.25 -99.54 1.32 Allowed Glycine 0 C--N 1.35 1.343 0 O-C-N 123.542 0.526 . . . . 0.0 112.52 177.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.15 -23.05 18.09 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.826 0.85 . . . . 0.0 110.389 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.516 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.24 -30.86 71.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 0.0 110.421 -175.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.431 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 60.0 pttt -62.8 -33.61 75.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.309 0.644 . . . . 0.0 111.806 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -88.71 -18.54 27.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.024 0.529 . . . . 0.0 111.315 -172.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -94.52 -1.53 53.25 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.049 0.54 . . . . 0.0 111.244 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.516 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -99.0 148.12 24.32 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 173.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.5 p -118.39 -171.95 2.18 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.528 0.731 . . . . 0.0 111.173 -170.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.06 -23.47 67.46 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.114 0.565 . . . . 0.0 112.458 178.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.1 t -88.01 -17.05 32.03 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.328 0.651 . . . . 0.0 111.753 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.458 ' OG ' ' HB2' ' A' ' 24' ' ' LEU . 79.0 p -77.33 128.06 33.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.44 0.296 . . . . 0.0 110.214 -178.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.4 t -81.38 143.04 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 124.571 1.149 . . . . 0.0 109.772 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.543 ' HA ' HG12 ' A' ' 34' ' ' ILE . 64.4 mt -102.33 -67.81 0.86 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.397 0.679 . . . . 0.0 110.236 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.533 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.2 tt -57.46 115.74 2.92 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.88 0.872 . . . . 0.0 111.442 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.59 -22.54 7.5 Favored Glycine 0 C--N 1.353 1.479 0 CA-C-N 115.747 -0.661 . . . . 0.0 114.272 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -90.1 -47.18 7.98 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.709 0.804 . . . . 0.0 110.687 -176.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.543 HG12 ' HA ' ' A' ' 30' ' ' LEU . 43.8 mm -75.63 122.16 86.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.07 -8.55 23.92 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.797 2.331 . . . . 0.0 113.288 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -90.49 -28.85 18.29 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 173.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.533 HD12 ' HA ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -74.53 94.26 2.6 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -125.74 -166.21 1.53 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 125.246 1.418 . . . . 0.0 107.705 171.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.54 ' O ' HG22 ' A' ' 42' ' ' VAL . 12.9 m -41.82 -69.39 0.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.605 1.562 . . . . 0.0 114.58 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 mmt -70.74 -23.92 62.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.242 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.426 ' O ' HG21 ' A' ' 45' ' ' VAL . . . -60.71 -41.77 95.88 Favored 'General case' 0 C--N 1.345 0.392 0 O-C-N 123.932 0.77 . . . . 0.0 111.405 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -63.13 -42.38 96.33 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.1 t -63.81 -45.6 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.729 0.776 . . . . 0.0 110.354 -176.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -58.23 -47.96 81.88 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.502 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.442 ' O ' HD21 ' A' ' 49' ' ' LEU . 24.8 m -76.01 -25.29 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 119.069 -0.491 . . . . 0.0 112.017 -175.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 42' ' ' VAL . 90.7 mt -62.74 -55.73 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 171.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.7 m -54.98 -46.91 75.14 Favored 'General case' 0 C--N 1.356 0.888 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.795 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.97 89.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.991 0.917 . . . . 0.0 111.621 -177.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -53.89 -43.55 69.75 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.293 0.637 . . . . 0.0 110.071 175.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.435 ' HG2' ' H ' ' A' ' 57' ' ' VAL . 42.9 mt-10 -61.8 -45.4 94.0 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.309 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 47' ' ' THR . 44.1 mm-40 -63.39 -55.18 26.51 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.177 0.591 . . . . 0.0 111.477 -176.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -69.0 -42.06 76.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.147 0.579 . . . . 0.0 112.439 -174.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -82.65 -11.31 58.46 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 66.43 38.02 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.654 1.182 . . . . 0.0 111.69 174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.3 -168.7 1.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.716 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.5 t -133.51 116.99 16.62 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 167.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.435 ' H ' ' HG2' ' A' ' 50' ' ' GLU . 48.0 t -69.75 113.8 6.17 Favored 'Isoleucine or valine' 0 C--N 1.351 0.636 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 173.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.506 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.0 t70 -70.3 148.85 48.02 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.671 0.789 . . . . 0.0 110.784 -173.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -56.97 -41.49 78.44 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.336 0.654 . . . . 0.0 112.491 -176.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.63 -27.29 67.57 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.51 0.724 . . . . 0.0 112.308 -174.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -95.79 -5.42 41.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.241 0.616 . . . . 0.0 111.129 -177.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 58' ' ' ASP . 58.2 mt -83.67 106.82 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 122.735 0.414 . . . . 0.0 110.02 175.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -128.28 173.98 9.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.035 0.934 . . . . 0.0 109.546 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.91 -31.27 70.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.079 0.552 . . . . 0.0 110.149 169.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -67.11 -18.97 65.55 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.396 175.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.5 m -73.68 -37.28 65.28 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.491 ' HA ' HD22 ' A' ' 73' ' ' LEU . 68.1 m-85 -107.83 15.76 24.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.519 0.728 . . . . 0.0 112.196 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.78 -42.69 94.89 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.371 0.419 . . . . 0.0 110.477 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.0 t -146.85 166.18 27.47 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.034 0.534 . . . . 0.0 110.606 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.406 HD21 HD13 ' A' ' 24' ' ' LEU . 61.9 tp -62.47 -35.48 79.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.071 0.549 . . . . 0.0 110.681 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.24 -32.14 79.6 Favored Glycine 0 C--N 1.351 1.402 0 O-C-N 123.688 0.618 . . . . 0.0 112.72 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.4 m -68.4 -52.65 30.61 Favored 'General case' 0 C--N 1.347 0.5 0 C-N-CA 123.161 0.585 . . . . 0.0 110.469 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.491 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.1 mm? -61.57 -42.24 98.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 117.812 0.278 . . . . 0.0 111.497 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.528 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.46 -46.74 80.22 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.071 0.857 . . . . 0.0 110.248 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.438 HD21 ' HE2' ' A' ' 1' ' ' MET . 0.2 OUTLIER -59.9 -49.66 76.83 Favored 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 124.208 1.003 . . . . 0.0 110.599 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.468 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 18.1 m-85 -60.07 -50.47 73.59 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.52 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.71 -28.89 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.652 0.381 . . . . 0.0 111.695 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.528 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 50.2 mm-40 -60.27 -46.79 88.61 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 170.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.27 -29.4 70.49 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.927 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -70.32 -56.61 6.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.101 0.56 . . . . 0.0 111.908 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.21 -14.02 62.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.547 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 122.259 0.224 . . . . 0.0 110.614 170.759 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.598 ' HE1' HD22 ' A' ' 75' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.3 -37.8 8.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.341 1.056 . . . . 0.0 110.841 176.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.437 ' O ' HG22 ' A' ' 7' ' ' VAL . 79.4 m-70 -79.93 -16.5 55.16 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -169.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.409 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 2.4 pt? -53.5 -28.67 32.21 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.499 0.59 . . . . 0.0 111.622 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -57.81 -56.54 20.69 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.496 1.518 . . . . 0.0 110.409 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.417 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.41 -28.3 64.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.802 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.437 HG22 ' O ' ' A' ' 3' ' ' HIS . 95.2 t -68.29 -50.6 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.075 0 C-N-CA 122.474 0.31 . . . . 0.0 110.924 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 19.0 ptt85 -70.52 -24.04 62.75 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.415 0.286 . . . . 0.0 110.56 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.14 -48.47 81.46 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.795 170.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 6' ' ' ALA . 81.3 mt -60.48 -57.73 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.936 0.894 . . . . 0.0 111.74 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.447 ' HG ' HG11 ' A' ' 45' ' ' VAL . 9.2 mp -64.31 -34.92 79.25 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 123.083 0.239 . . . . 0.0 110.999 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.549 ' HA3' ' HD2' ' A' ' 21' ' ' LYS . . . -66.51 -34.39 87.55 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-N 116.239 -0.437 . . . . 0.0 113.376 174.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -72.06 -52.05 18.7 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.577 0.751 . . . . 0.0 109.893 -178.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.4 t -66.63 -53.17 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.014 0.926 . . . . 0.0 110.655 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.497 HD13 ' HB1' ' A' ' 41' ' ' ALA . 2.6 mm? -87.91 -5.24 58.66 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 65.1 56.02 1.07 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.996 0.903 . . . . 0.0 110.925 174.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.543 HD13 HD12 ' A' ' 34' ' ' ILE . 4.3 mm? -70.48 -31.7 68.93 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 178.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 73.89 -98.58 0.98 Allowed Glycine 0 C--N 1.342 0.877 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.334 -178.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.69 -11.74 19.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.953 0.901 . . . . 0.0 111.152 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.463 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -72.26 -29.29 63.77 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -178.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.549 ' HD2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -69.15 -10.76 59.23 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 173.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -89.35 -36.94 15.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.116 0.566 . . . . 0.0 110.722 177.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.2 t -76.88 -21.61 54.69 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.647 0.379 . . . . 0.0 111.217 -173.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -86.99 146.84 25.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.8 p -123.72 -169.47 1.95 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.463 1.105 . . . . 0.0 109.218 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.78 72.87 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.611 0.364 . . . . 0.0 110.786 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.8 m -80.78 2.56 25.71 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.627 0.771 . . . . 0.0 112.44 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -95.29 145.57 24.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.84 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -77.95 156.87 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.303 1.041 . . . . 0.0 109.139 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.5 mt -119.87 -62.98 1.42 Allowed 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.902 -0.499 . . . . 0.0 110.234 177.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.461 HD22 HD11 ' A' ' 37' ' ' LEU . 93.8 mt -55.34 112.3 1.07 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.307 0.643 . . . . 0.0 110.984 172.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.49 -33.48 4.95 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.017 -0.538 . . . . 0.0 113.328 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.43 -41.31 69.66 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.165 0.586 . . . . 0.0 110.174 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.543 HD12 HD13 ' A' ' 17' ' ' LEU . 20.3 mm -90.35 119.22 69.19 Favored Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 174.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.86 -12.28 32.41 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.685 2.256 . . . . 0.0 112.79 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -93.15 -23.87 18.44 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.169 0.588 . . . . 0.0 111.384 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.461 HD11 HD22 ' A' ' 31' ' ' LEU . 1.2 tm? -79.46 82.32 5.6 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -176.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' O ' HG12 ' A' ' 42' ' ' VAL . 17.9 t70 -115.68 -155.34 0.57 Allowed 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 125.081 1.352 . . . . 0.0 108.739 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.573 ' O ' HG22 ' A' ' 42' ' ' VAL . 36.0 t -54.26 -71.7 0.07 Allowed 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.078 1.351 . . . . 0.0 113.991 -169.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.67 -24.08 67.64 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.649 -0.657 . . . . 0.0 112.016 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.497 ' HB1' HD13 ' A' ' 15' ' ' LEU . . . -67.87 -37.97 82.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.45 0.7 . . . . 0.0 111.678 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' SER . 6.3 m -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 C--N 1.369 1.456 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 174.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 t -70.33 -40.49 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.829 -176.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -63.81 -41.22 97.93 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.233 1.013 . . . . 0.0 112.076 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.447 HG11 ' HG ' ' A' ' 11' ' ' LEU . 21.7 m -74.37 -33.06 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.355 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.452 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.8 mt -59.43 -47.28 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 41.5 m -59.18 -43.48 92.16 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.109 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -32.26 73.54 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.679 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.8 -45.58 91.89 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 2.4 mm-40 -57.39 -49.34 76.5 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.617 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 47' ' ' THR . 17.6 mm-40 -67.02 -52.45 42.24 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.465 0.706 . . . . 0.0 111.995 -174.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.66 -60.66 3.33 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.7 0.8 . . . . 0.0 111.718 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -78.02 -17.77 56.68 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.232 0.332 . . . . 0.0 111.43 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 65.6 62.43 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.768 1.227 . . . . 0.0 109.82 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.38 -166.61 2.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.656 176.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.5 m -133.01 113.09 12.4 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 123.204 0.602 . . . . 0.0 109.974 167.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 70.7 t -73.17 108.84 4.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.713 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 167.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 22.9 t70 -63.08 148.91 46.48 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.509 -171.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.3 -32.09 71.94 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.895 0.478 . . . . 0.0 112.0 -175.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -70.19 -27.92 64.89 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.535 0.734 . . . . 0.0 111.533 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.1 pt-20 -92.68 -12.48 31.39 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.183 0.193 . . . . 0.0 110.973 -178.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 58' ' ' ASP . 45.5 mt -84.91 106.94 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 122.92 0.488 . . . . 0.0 110.149 175.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.2 p -130.0 179.68 5.73 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.361 1.064 . . . . 0.0 108.703 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.37 -34.5 78.31 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.014 174.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -67.92 -12.71 61.23 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.314 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -70.65 -40.09 73.25 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.829 0.451 . . . . 0.0 110.603 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.482 ' HA ' HD21 ' A' ' 73' ' ' LEU . 52.5 m-85 -107.61 18.26 21.66 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.439 ' HG3' HG23 ' A' ' 69' ' ' THR . 11.1 pt-20 -61.73 -38.35 87.58 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.439 HG23 ' HG3' ' A' ' 68' ' ' GLU . 8.3 t -146.24 160.6 41.77 Favored 'General case' 0 C--O 1.25 1.103 0 C-N-CA 123.315 0.646 . . . . 0.0 110.729 175.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.5 tp -63.6 -29.62 70.84 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.67 -38.22 95.37 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.992 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.435 ' H ' HG22 ' A' ' 69' ' ' THR . 64.4 m -58.67 -51.53 69.52 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -58.37 -45.48 88.19 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 123.667 0.605 . . . . 0.0 111.194 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -55.45 -45.45 76.86 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.708 1.255 . . . . 0.0 110.143 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.598 HD22 ' HE1' ' A' ' 1' ' ' MET . 3.9 mm? -66.47 -43.57 85.09 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.724 0.64 . . . . 0.0 111.548 179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.497 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 21.3 m-85 -54.32 -55.78 25.04 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.5 m -73.39 -24.79 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.148 0.979 . . . . 0.0 112.301 -174.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.584 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.0 mm-40 -55.64 -54.95 37.88 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 168.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -69.08 -32.08 71.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.765 -171.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.71 -54.96 41.0 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.23 0.612 . . . . 0.0 110.721 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -80.73 -13.55 58.89 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.777 -177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.478 0.929 0 C-N-CA 122.362 0.265 . . . . 0.0 110.413 170.957 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.543 ' HE2' HD22 ' A' ' 75' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -94.51 -53.96 3.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 122.05 0.929 . . . . 0.0 108.741 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.401 ' O ' HG23 ' A' ' 7' ' ' VAL . 97.6 m-70 -70.8 -17.71 62.76 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.0 -1.909 . . . . 0.0 113.419 -164.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -50.09 -34.35 21.55 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -72.3 -42.37 65.55 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 122.511 0.324 . . . . 0.0 110.617 -176.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.83 -33.88 76.87 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.214 0.605 . . . . 0.0 111.07 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 3' ' ' HIS . 83.9 t -66.66 -50.79 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.153 0.581 . . . . 0.0 109.767 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.9 ptt180 -68.6 -26.83 65.57 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.711 0.404 . . . . 0.0 110.634 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.412 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 32.0 t30 -61.64 -50.01 74.24 Favored 'General case' 0 C--O 1.25 1.09 0 C-N-CA 123.996 0.919 . . . . 0.0 109.758 175.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.19 -50.06 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.719 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.3 mt -58.86 -39.89 82.7 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.433 0.693 . . . . 0.0 111.475 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.424 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -71.98 -28.08 69.29 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-O 119.851 -0.416 . . . . 0.0 113.337 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -75.41 -39.51 58.88 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 117.031 0.415 . . . . 0.0 110.686 175.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.2 t -75.18 -54.29 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.005 0.522 . . . . 0.0 110.493 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.538 HD12 ' HB1' ' A' ' 41' ' ' ALA . 2.4 mm? -84.78 1.44 46.7 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.172 0.589 . . . . 0.0 112.072 -176.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 65.82 46.61 2.26 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 122.22 1.009 . . . . 0.0 111.245 170.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 mp -77.52 -34.95 53.88 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.873 172.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.49 -91.24 0.25 Allowed Glycine 0 C--N 1.352 1.455 0 O-C-N 123.912 0.757 . . . . 0.0 113.072 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -92.5 -28.92 16.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.984 0.914 . . . . 0.0 110.657 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HA ' HG21 ' A' ' 23' ' ' THR . 0.2 OUTLIER -65.54 -24.64 67.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.692 0.797 . . . . 0.0 111.435 -173.492 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.424 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 61.0 pttt -65.18 -27.03 68.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.847 0.459 . . . . 0.0 111.817 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.8 t-80 -92.01 -22.96 19.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.774 0.43 . . . . 0.0 110.877 -175.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.406 HG21 ' HA ' ' A' ' 20' ' ' ARG . 7.2 t -86.15 -1.05 57.06 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.359 0.264 . . . . 0.0 111.187 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -103.64 156.43 17.8 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.956 0.408 . . . . 0.0 110.146 172.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.3 p -121.51 -172.34 2.4 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.216 1.006 . . . . 0.0 110.178 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.3 81.23 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 t -75.18 -3.73 34.7 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.002 0.521 . . . . 0.0 112.194 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.1 t -67.68 137.1 55.29 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.001 0.521 . . . . 0.0 110.498 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -86.7 150.69 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.918 0.887 . . . . 0.0 109.863 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.3 mt -109.02 -66.93 1.01 Allowed 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.5 mt -54.41 121.39 8.21 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.842 0.857 . . . . 0.0 111.264 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.76 -28.56 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 119.533 -0.593 . . . . 0.0 113.809 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -77.71 -66.21 0.87 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.498 0.649 . . . . 0.0 110.021 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.16 119.27 76.81 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.192 -175.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.99 -15.52 36.26 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 122.315 2.01 . . . . 0.0 111.899 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -88.04 -29.26 20.81 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.944 0.898 . . . . 0.0 110.152 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.8 100.57 3.48 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -132.52 -156.83 0.78 Allowed 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.634 ' O ' HG22 ' A' ' 42' ' ' VAL . 58.0 p -67.46 -54.52 19.5 Favored 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -167.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 97.0 mmm -61.55 -27.52 68.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.691 -1.255 . . . . 0.0 111.263 177.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.538 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -68.24 -33.73 74.93 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.795 175.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 39' ' ' SER . 5.9 m -64.68 -37.62 80.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 118.791 0.723 . . . . 0.0 109.645 175.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.49 -48.15 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 121.499 0.666 . . . . 0.0 109.956 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -60.41 -45.84 92.15 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 113.799 -1.546 . . . . 0.0 112.634 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 32.6 m -71.05 -31.94 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 119.031 -0.509 . . . . 0.0 111.575 -176.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.425 HD12 HD12 ' A' ' 62' ' ' ILE . 82.3 mt -63.48 -50.57 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -50.91 -48.76 60.52 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.508 1.13 . . . . 0.0 110.922 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.44 -46.82 84.5 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.798 -178.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.2 -45.23 75.86 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.576 0.75 . . . . 0.0 110.366 176.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.5 -40.1 96.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.823 0.849 . . . . 0.0 112.05 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -65.48 -52.52 52.27 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.43 0.692 . . . . 0.0 112.139 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.49 -49.48 40.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -176.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -75.45 -16.76 60.3 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.834 0.454 . . . . 0.0 111.755 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.49 46.76 3.2 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.432 1.11 . . . . 0.0 110.273 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.93 -170.78 2.58 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.483 175.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.9 t -126.08 117.14 22.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 166.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.12 108.54 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.76 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.577 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.2 t70 -72.8 144.23 47.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.463 0.705 . . . . 0.0 111.286 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.55 -38.7 64.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.875 0.87 . . . . 0.0 112.626 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -71.6 -21.19 61.89 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.218 0.607 . . . . 0.0 111.99 -172.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 10.8 pt-20 -94.6 -17.39 22.36 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.425 HD12 HD12 ' A' ' 46' ' ' ILE . 76.7 mt -81.05 109.39 15.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 123.185 0.594 . . . . 0.0 110.078 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.3 t -130.11 170.4 14.08 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 164.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.91 76.06 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -63.95 -18.97 64.78 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.498 0.719 . . . . 0.0 112.243 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.6 m -64.47 -38.81 92.3 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.283 0.633 . . . . 0.0 110.097 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.528 ' HA ' HD23 ' A' ' 73' ' ' LEU . 77.3 m-85 -96.17 19.45 11.77 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.34 1.056 . . . . 0.0 112.623 -177.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.64 -48.9 77.36 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 123.091 0.244 . . . . 0.0 110.447 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.6 p -142.05 162.59 35.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.816 0.847 . . . . 0.0 110.395 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 60.9 tp -56.29 -40.32 74.12 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.017 0.927 . . . . 0.0 111.386 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.74 -35.45 92.03 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 114.513 -1.222 . . . . 0.0 112.034 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 m -62.2 -51.03 69.43 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 122.959 0.504 . . . . 0.0 110.483 177.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.07 -42.56 80.84 Favored 'General case' 0 C--N 1.365 1.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.887 176.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.74 -43.25 85.24 Favored 'General case' 0 C--O 1.21 -1.018 0 O-C-N 124.686 1.241 . . . . 0.0 110.973 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.543 HD22 ' HE2' ' A' ' 1' ' ' MET . 3.0 mm? -61.87 -51.47 68.07 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.864 0.727 . . . . 0.0 110.791 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.52 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 68.5 m-85 -55.69 -49.7 72.25 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 123.668 0.605 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.2 m -72.64 -24.86 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.163 0.585 . . . . 0.0 112.018 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.5 mm-40 -56.82 -53.73 54.53 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 169.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -58.69 -43.24 89.93 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.487 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -53.52 -59.02 5.13 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 124.118 0.886 . . . . 0.0 112.157 -177.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -79.22 -13.89 59.41 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.121 -174.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 N--CA 1.477 0.908 0 C-N-CA 122.751 0.42 . . . . 0.0 111.478 174.86 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -36.71 -47.36 0.66 Allowed 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 115.903 1.816 . . . . 0.0 115.903 -162.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.404 ' O ' HG23 ' A' ' 7' ' ' VAL . 39.1 m-70 -68.48 -25.98 65.25 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.47 -30.78 8.69 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 123.925 0.89 . . . . 0.0 112.776 -179.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.86 -50.58 66.05 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 124.315 1.046 . . . . 0.0 110.797 -176.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.22 -25.7 55.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.882 -179.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 3' ' ' HIS . 70.5 t -67.29 -49.59 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -71.55 -24.46 61.94 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.096 0.558 . . . . 0.0 110.3 -178.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.429 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 6.4 t30 -60.95 -50.26 74.12 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.252 0.621 . . . . 0.0 109.666 171.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.35 -46.86 95.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.481 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.2 mt -62.71 -42.51 99.68 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.01 0.524 . . . . 0.0 110.494 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.568 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -68.17 -22.15 74.23 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.436 -0.802 . . . . 0.0 113.239 178.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -84.3 -47.44 10.75 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.372 0.669 . . . . 0.0 111.504 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.16 -58.24 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.455 0.702 . . . . 0.0 110.447 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.5 mm? -80.76 -14.02 58.46 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.792 0.437 . . . . 0.0 110.605 -175.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 67.16 64.47 0.44 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.338 1.055 . . . . 0.0 109.714 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.477 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 3.6 mm? -79.33 -27.04 42.07 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.386 -0.825 . . . . 0.0 108.904 164.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.422 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 64.43 -100.82 0.45 Allowed Glycine 0 C--N 1.354 1.55 0 O-C-N 123.664 0.602 . . . . 0.0 113.636 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -89.09 -23.63 22.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.955 0.902 . . . . 0.0 110.795 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.424 ' HD2' HD11 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -70.81 -22.6 62.33 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.573 0.749 . . . . 0.0 111.003 -176.41 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.568 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 22.8 pttm -63.99 -23.6 67.4 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.138 -0.351 . . . . 0.0 110.927 173.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -80.69 -23.83 39.3 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.364 0.666 . . . . 0.0 111.485 -178.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.4 t -94.43 -15.72 24.03 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -91.27 149.48 21.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 81.4 p -118.4 -169.89 1.79 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.361 1.064 . . . . 0.0 109.36 -177.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.17 63.8 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 122.927 0.491 . . . . 0.0 112.195 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -74.16 -16.53 60.99 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.978 0.911 . . . . 0.0 112.452 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.6 p -66.51 123.11 19.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.03 0.532 . . . . 0.0 111.043 -176.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.5 t -75.98 148.67 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 175.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.5 mt -113.83 -67.65 0.98 Allowed 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.076 -0.39 . . . . 0.0 110.145 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.89 111.37 1.14 Allowed 'General case' 0 C--N 1.35 0.625 0 C-N-CA 122.98 0.512 . . . . 0.0 110.926 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 -34.62 4.98 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-N 115.216 -0.902 . . . . 0.0 113.191 178.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -80.76 -45.57 16.82 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.266 0.626 . . . . 0.0 110.856 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 23.4 mm -90.67 116.15 65.77 Favored Pre-proline 0 C--O 1.243 0.734 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 177.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.15 -4.86 14.71 Favored 'Trans proline' 0 C--N 1.368 1.583 0 C-N-CA 122.446 2.097 . . . . 0.0 112.401 -177.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 14.4 mm-40 -89.26 -18.42 27.05 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.397 0.679 . . . . 0.0 110.151 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 56.9 tp -83.63 87.64 7.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.597 0.713 . . . . 0.0 109.189 -177.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -85.53 173.14 10.42 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.94 1.296 . . . . 0.0 110.287 176.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.635 ' O ' HG23 ' A' ' 42' ' ' VAL . 40.9 t -49.32 -65.21 0.61 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 125.337 1.455 . . . . 0.0 112.231 169.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.0 mmt -60.88 -23.76 65.44 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.306 -0.871 . . . . 0.0 111.981 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.14 -28.39 62.22 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 39' ' ' SER . 4.3 m -66.16 -37.53 79.95 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -67.0 -39.45 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.85 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -59.66 -47.4 85.76 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.756 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.48 -30.46 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.753 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.473 HD11 HD11 ' A' ' 62' ' ' ILE . 97.0 mt -64.5 -48.19 86.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.457 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.7 m -58.74 -44.71 90.57 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.267 0.979 . . . . 0.0 110.532 177.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.97 89.35 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.129 178.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -58.2 -45.77 87.0 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.146 0.578 . . . . 0.0 109.635 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.5 mm-40 -51.5 -49.25 62.24 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 124.325 1.015 . . . . 0.0 110.037 175.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 47' ' ' THR . 25.4 mm-40 -62.1 -66.32 0.56 Allowed 'General case' 0 C--N 1.353 0.727 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.695 -173.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -70.6 -37.14 73.85 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -168.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -88.33 -14.84 37.21 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.325 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 63.79 46.12 4.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.28 1.032 . . . . 0.0 111.548 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.493 ' CZ ' HG22 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -141.52 -171.94 3.42 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.316 -179.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 t -126.0 130.91 52.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 122.918 0.487 . . . . 0.0 110.149 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.493 HG22 ' CZ ' ' A' ' 55' ' ' PHE . 2.6 t -86.31 118.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 172.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.475 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 27.0 t70 -76.08 144.8 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.4 0.68 . . . . 0.0 111.838 -170.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -55.22 -40.06 70.4 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.131 0.973 . . . . 0.0 113.377 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.34 -32.32 68.41 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.276 0.631 . . . . 0.0 112.068 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.4 pt-20 -85.96 -23.62 26.85 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.473 HD11 HD11 ' A' ' 46' ' ' ILE . 68.9 mt -72.25 110.12 5.05 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t -139.76 175.82 9.25 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 171.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.9 71.61 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -63.97 -21.4 66.47 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.143 0.977 . . . . 0.0 112.26 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.451 HG21 HD12 ' A' ' 73' ' ' LEU . 20.7 m -81.97 -41.13 21.21 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.189 0.595 . . . . 0.0 110.17 175.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.487 ' HA ' HD21 ' A' ' 73' ' ' LEU . 61.9 m-85 -101.02 7.25 43.57 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.556 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -62.33 -41.24 98.39 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.948 0.499 . . . . 0.0 111.426 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.556 HG22 ' HG3' ' A' ' 68' ' ' GLU . 7.1 t -148.6 154.76 40.17 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.518 0.727 . . . . 0.0 110.052 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.2 tp -56.21 -33.02 64.94 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.201 1.0 . . . . 0.0 111.604 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.18 -43.25 99.64 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.531 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -61.88 -44.14 97.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.968 0.507 . . . . 0.0 111.05 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.5 mm? -59.01 -47.57 84.71 Favored 'General case' 0 C--N 1.363 1.166 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.601 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -53.41 -52.86 58.01 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 124.624 1.203 . . . . 0.0 110.031 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.1 -45.15 93.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.11 0.964 . . . . 0.0 112.224 -174.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.455 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.7 m-85 -60.44 -49.89 75.77 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.256 0.222 . . . . 0.0 110.867 177.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.2 m -71.39 -23.84 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 122.521 0.329 . . . . 0.0 111.132 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 81.8 mm-40 -56.86 -50.48 72.33 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -57.79 -47.96 81.07 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.108 0.88 . . . . 0.0 110.733 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.6 mmmt -62.7 -55.01 30.71 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.209 -172.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.69 -12.24 60.95 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.511 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 CA--C 1.551 1.019 0 C-N-CA 123.057 0.543 . . . . 0.0 111.49 171.292 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.4 ' N ' ' SD ' ' A' ' 1' ' ' MET . 3.8 mpp? . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.767 0.318 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -92.25 -45.59 8.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.289 1.042 . . . . 0.0 108.216 176.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -79.48 -9.84 59.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 113.498 -1.683 . . . . 0.0 113.597 -164.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -53.13 -30.27 35.86 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.632 0.651 . . . . 0.0 112.341 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.68 -51.67 61.26 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.048 0.939 . . . . 0.0 110.793 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.473 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.56 -35.55 75.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.429 -177.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.2 t -63.91 -50.34 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 122.923 0.489 . . . . 0.0 109.814 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -67.88 -28.65 67.7 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.773 0.429 . . . . 0.0 110.461 -177.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -61.89 -48.77 79.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.656 0.782 . . . . 0.0 109.881 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.5 mt -59.13 -55.24 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.191 0.996 . . . . 0.0 110.995 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.37 -45.2 88.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.116 -174.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.455 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.37 -19.48 79.83 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 116.265 -0.425 . . . . 0.0 113.536 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.8 -38.33 58.29 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.983 0.391 . . . . 0.0 110.104 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -75.29 -56.43 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.529 0.732 . . . . 0.0 110.37 -178.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.4 mm? -81.75 2.19 31.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.513 0.725 . . . . 0.0 112.031 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.6 34.49 2.72 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.434 1.093 . . . . 0.0 111.897 168.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.427 ' HG ' ' HD2' ' A' ' 20' ' ' ARG . 6.0 mp -68.12 -33.71 75.01 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.872 0.869 . . . . 0.0 111.256 177.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.26 -95.13 0.57 Allowed Glycine 0 C--N 1.351 1.411 0 O-C-N 123.463 0.477 . . . . 0.0 113.095 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -96.33 -24.7 16.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.0 0.92 . . . . 0.0 110.434 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.478 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.1 OUTLIER -61.68 -28.74 69.61 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.424 0.69 . . . . 0.0 111.423 -176.103 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.455 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.2 pttt -65.98 -26.25 67.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.376 0.67 . . . . 0.0 112.224 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -96.73 -20.93 17.88 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.272 0.629 . . . . 0.0 110.998 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.478 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.1 t -87.2 4.96 40.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.769 0.427 . . . . 0.0 111.38 179.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -107.69 169.87 8.33 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.376 0.67 . . . . 0.0 109.684 171.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.5 p -127.18 -171.38 2.4 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 0.0 109.56 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.74 -31.54 70.86 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.907 0.483 . . . . 0.0 112.016 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -73.4 -4.93 36.58 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -71.6 129.74 39.46 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.03 0.532 . . . . 0.0 110.835 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.2 t -73.63 155.33 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 124.409 1.083 . . . . 0.0 108.72 171.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 27.3 mt -124.59 -67.13 0.93 Allowed 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 68' ' ' GLU . 5.2 tt -64.96 110.86 2.6 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 172.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.98 -32.13 7.83 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 123.477 0.486 . . . . 0.0 112.73 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -84.31 -65.41 1.01 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.78 0.832 . . . . 0.0 110.434 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.4 mm -71.86 118.12 63.96 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.527 -171.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.92 -4.13 14.85 Favored 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 122.559 2.173 . . . . 0.0 112.442 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 37.7 mm-40 -99.32 -10.24 22.56 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.318 1.047 . . . . 0.0 111.045 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -78.29 82.95 4.56 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -91.85 169.63 10.53 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.587 1.555 . . . . 0.0 110.439 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.553 ' O ' HG21 ' A' ' 42' ' ' VAL . 45.9 t -44.25 -65.73 0.48 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 126.508 1.923 . . . . 0.0 112.637 170.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.4 mmm -68.03 -21.73 65.0 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.896 -0.503 . . . . 0.0 111.522 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -74.49 -23.87 58.93 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 118.273 -0.87 . . . . 0.0 112.053 174.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.553 HG21 ' O ' ' A' ' 39' ' ' SER . 2.9 m -67.96 -39.55 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 171.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 t -63.35 -44.46 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.162 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.06 -44.37 96.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.306 -1.316 . . . . 0.0 112.887 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -74.2 -30.37 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-O 119.318 -0.373 . . . . 0.0 111.595 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.512 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -61.56 -55.86 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.458 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.9 m -56.12 -39.83 72.82 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 124.629 1.206 . . . . 0.0 111.369 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.4 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -64.69 -46.01 84.19 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.767 0.827 . . . . 0.0 111.69 178.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -54.96 -44.8 74.7 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.328 0.651 . . . . 0.0 110.244 174.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 10.2 mm-40 -53.72 -50.02 66.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.524 1.129 . . . . 0.0 111.447 176.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.6 mm-40 -64.84 -55.8 17.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.542 0.737 . . . . 0.0 111.954 -174.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.4 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 56.5 m-85 -62.6 -56.02 21.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.365 0.666 . . . . 0.0 111.954 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.39 -9.74 59.66 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.2 t70 67.15 35.4 4.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 124.502 1.121 . . . . 0.0 111.106 169.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -173.6 3.44 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.262 0.625 . . . . 0.0 110.772 -171.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.4 m -128.9 113.43 15.22 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.382 0.673 . . . . 0.0 111.362 172.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.74 118.3 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 164.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.571 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 20.7 t70 -72.28 145.88 47.57 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.175 0.443 . . . . 0.0 109.98 -174.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.46 -25.98 67.75 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 121.706 -0.621 . . . . 0.0 112.468 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -76.44 -7.2 54.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.952 0.501 . . . . 0.0 112.071 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.9 pt-20 -111.29 -20.25 12.36 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.825 0.45 . . . . 0.0 110.575 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 58' ' ' ASP . 56.3 mt -77.69 114.58 18.38 Favored 'Isoleucine or valine' 0 C--N 1.357 0.928 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 175.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.6 p -131.75 177.22 7.69 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.676 1.191 . . . . 0.0 108.127 168.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.04 73.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.676 0.75 . . . . 0.0 109.756 171.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -69.79 -11.37 60.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.261 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -80.14 -40.46 27.34 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 122.797 0.439 . . . . 0.0 110.023 173.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.554 ' HA ' HD23 ' A' ' 73' ' ' LEU . 37.7 m-85 -99.31 14.03 31.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.548 0.339 . . . . 0.0 111.775 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 11.4 pt-20 -60.95 -40.39 93.11 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 123.786 0.679 . . . . 0.0 112.0 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.2 m -151.82 150.11 29.76 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.096 0.958 . . . . 0.0 109.796 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 tp -53.54 -42.75 67.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.125 0.97 . . . . 0.0 111.861 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.78 -38.23 91.7 Favored Glycine 0 C--N 1.341 0.822 0 O-C-N 124.534 1.146 . . . . 0.0 112.251 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m -58.79 -53.52 57.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.217 0.607 . . . . 0.0 110.268 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.554 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.26 -39.01 91.48 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.385 0.274 . . . . 0.0 110.816 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.598 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.8 -46.23 91.32 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 124.493 1.121 . . . . 0.0 110.334 -177.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -65.07 -44.39 89.11 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.885 0.741 . . . . 0.0 110.883 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.462 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 15.9 m-85 -56.61 -46.9 80.65 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.73 0.412 . . . . 0.0 111.06 179.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.8 m -75.3 -24.63 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 122.832 0.453 . . . . 0.0 111.596 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.5 mm-40 -57.53 -43.58 84.47 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 169.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -67.07 -55.88 12.41 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.211 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -63.82 -54.21 38.63 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.698 0.799 . . . . 0.0 112.235 -168.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.82 -17.63 63.4 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 N--CA 1.48 1.041 0 C-N-CA 122.655 0.382 . . . . 0.0 111.191 177.465 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.695 0.283 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.02 -50.98 3.99 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.58 0.752 . . . . 0.0 111.074 172.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -82.09 0.31 41.2 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.664 -171.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -55.38 -34.76 64.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 123.53 0.519 . . . . 0.0 111.771 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -68.52 -45.01 73.36 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.834 0.709 . . . . 0.0 110.593 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.79 -33.73 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.096 0.559 . . . . 0.0 111.03 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.5 t -66.84 -49.95 69.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 122.872 0.469 . . . . 0.0 109.772 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.406 ' HG3' ' NZ ' ' A' ' 21' ' ' LYS . 36.3 ptt180 -70.8 -22.18 62.39 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.172 0.589 . . . . 0.0 110.877 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -65.05 -52.89 53.25 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.58 0.752 . . . . 0.0 109.57 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.64 -44.62 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.948 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 65.2 mt -63.38 -44.12 95.65 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.697 0.76 . . . . 0.0 110.277 175.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.541 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -66.72 -19.18 69.06 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 114.665 -1.152 . . . . 0.0 113.582 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -90.83 -52.73 4.72 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.243 0.617 . . . . 0.0 110.788 176.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 84.7 t -68.42 -47.24 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.981 0.912 . . . . 0.0 110.815 -173.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.612 HD13 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -83.75 -14.29 51.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.768 0.427 . . . . 0.0 110.791 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 63.26 62.72 0.96 Allowed 'General case' 0 C--N 1.355 0.825 0 C-N-CA 124.446 1.099 . . . . 0.0 110.286 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.541 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 10.0 mp -72.88 -34.34 66.64 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 114.915 -1.038 . . . . 0.0 109.2 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.35 -94.61 0.27 Allowed Glycine 0 C--N 1.353 1.492 0 O-C-N 123.908 0.755 . . . . 0.0 112.418 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -92.95 -18.49 22.67 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.521 0.728 . . . . 0.0 110.614 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.457 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.4 -31.43 72.53 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.731 0.412 . . . . 0.0 110.19 -178.381 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.406 ' NZ ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -70.0 -26.23 63.97 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.763 0.425 . . . . 0.0 111.823 174.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -70.58 -48.4 55.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.2 t -77.42 -7.21 55.79 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.784 -167.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.636 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 3.9 pp -103.22 157.2 17.17 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.679 0.392 . . . . 0.0 111.179 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 76.2 p -114.57 -169.54 1.56 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.327 1.051 . . . . 0.0 109.472 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.0 69.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.146 0.578 . . . . 0.0 111.35 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -69.54 -12.74 61.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.843 0.857 . . . . 0.0 112.847 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.636 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 46.0 t -59.21 134.56 57.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.972 0.909 . . . . 0.0 111.856 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -83.71 146.15 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.496 ' HA ' HG12 ' A' ' 34' ' ' ILE . 66.7 mt -114.27 -72.65 0.69 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.908 0.483 . . . . 0.0 110.642 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.35 113.36 2.87 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.23 -31.42 8.72 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-N 115.753 -0.658 . . . . 0.0 113.053 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -87.81 -57.61 2.88 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.838 0.455 . . . . 0.0 110.583 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.496 HG12 ' HA ' ' A' ' 30' ' ' LEU . 17.6 mm -71.74 119.82 76.44 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.45 -16.86 30.75 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.279 1.986 . . . . 0.0 111.807 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -86.88 -21.33 26.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.491 0.717 . . . . 0.0 110.902 -177.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -74.39 86.1 2.0 Allowed 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -98.8 173.73 6.73 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.282 1.433 . . . . 0.0 109.731 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.574 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.4 m -46.13 -64.52 0.73 Allowed 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 125.154 1.382 . . . . 0.0 113.22 169.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.7 mmt -63.71 -27.48 69.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 121.189 0.519 . . . . 0.0 110.928 -176.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.612 ' HB1' HD13 ' A' ' 15' ' ' LEU . . . -64.95 -35.96 82.84 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.583 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 39' ' ' SER . 3.7 m -66.47 -36.04 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-N 118.469 0.577 . . . . 0.0 109.644 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.0 t -64.85 -47.37 88.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 CA-C-O 121.391 0.615 . . . . 0.0 109.9 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -58.72 -46.09 88.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.185 -1.371 . . . . 0.0 112.954 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.1 -33.45 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.977 -0.535 . . . . 0.0 111.722 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 78.8 mt -62.79 -51.55 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 67.6 m -52.25 -44.52 64.93 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.639 1.212 . . . . 0.0 110.95 177.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.67 -48.89 79.78 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.755 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.5 -46.05 66.48 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.684 0.794 . . . . 0.0 110.592 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 5.8 mm-40 -56.34 -47.86 77.92 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.462 1.105 . . . . 0.0 111.05 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' THR . 24.0 mm-40 -65.28 -52.24 55.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.662 0.785 . . . . 0.0 111.736 -176.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -71.2 -38.25 72.06 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.8 -171.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -94.02 -8.08 40.91 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.776 0.43 . . . . 0.0 111.893 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 67.36 28.23 7.91 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.594 1.158 . . . . 0.0 111.963 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -126.17 -177.67 4.04 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.219 0.608 . . . . 0.0 111.09 -171.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.5 m -127.14 121.1 30.45 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.81 0.844 . . . . 0.0 110.959 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.45 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 10.8 t -74.66 134.4 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.545 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.2 t70 -76.18 137.72 40.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.869 0.467 . . . . 0.0 109.911 -176.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.28 -39.05 81.71 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.345 0.658 . . . . 0.0 112.104 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.13 -4.51 41.96 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.542 0.737 . . . . 0.0 112.746 -172.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -100.97 -31.76 10.96 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 58' ' ' ASP . 35.4 mt -70.43 111.96 4.8 Favored 'Isoleucine or valine' 0 C--N 1.354 0.781 0 CA-C-O 121.261 0.553 . . . . 0.0 110.568 -176.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 42.2 t -112.27 171.96 7.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.65 1.18 . . . . 0.0 108.414 169.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.1 -30.05 68.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 167.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -71.98 -10.37 59.68 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.055 0.942 . . . . 0.0 111.542 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.446 HG23 HD13 ' A' ' 73' ' ' LEU . 96.3 m -69.25 -33.16 72.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.545 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.8 m-85 -89.36 11.49 18.96 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 69' ' ' THR . 9.8 pt-20 -58.76 -47.42 84.74 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 118.084 0.402 . . . . 0.0 110.792 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' GLU . 62.7 p -140.18 162.63 34.79 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.508 0.723 . . . . 0.0 111.125 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.71 -42.46 93.1 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 124.056 0.943 . . . . 0.0 110.924 176.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.99 -27.4 70.33 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 124.476 1.11 . . . . 0.0 112.616 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.7 m -67.67 -52.46 37.69 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 122.729 0.412 . . . . 0.0 110.754 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.545 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -60.81 -38.24 84.72 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 117.788 0.267 . . . . 0.0 110.769 176.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.01 63.11 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 124.344 1.027 . . . . 0.0 110.049 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.25 -44.91 92.36 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 123.967 0.792 . . . . 0.0 110.483 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.506 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 6.5 m-85 -58.62 -55.83 30.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.207 0.603 . . . . 0.0 111.512 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.8 m -66.67 -27.36 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.412 0.285 . . . . 0.0 111.39 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.57 -28.26 63.72 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.051 0.54 . . . . 0.0 111.036 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 63.2 m170 -73.45 -38.16 65.57 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.753 0.421 . . . . 0.0 110.169 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -69.54 -54.07 15.93 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.887 0.875 . . . . 0.0 112.238 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.68 -14.47 60.35 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.958 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 51.5 m . . . . . 0 N--CA 1.482 1.161 0 CA-C-N 118.078 0.399 . . . . 0.0 110.559 174.186 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.433 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -36.91 9.98 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.356 0.662 . . . . 0.0 110.869 177.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -77.89 -14.2 59.63 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-O 118.541 -0.742 . . . . 0.0 112.948 -167.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -51.89 -34.0 39.32 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 123.439 0.695 . . . . 0.0 112.068 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.49 -49.83 69.83 Favored 'General case' 0 C--N 1.352 0.715 0 C-N-CA 124.196 0.998 . . . . 0.0 110.671 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.64 -25.2 60.17 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.501 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.3 t -69.15 -48.83 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.634 0.373 . . . . 0.0 110.051 176.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.453 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 38.9 ptt180 -69.82 -25.58 63.83 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.52 0.328 . . . . 0.0 110.305 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -65.19 -47.42 77.01 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 123.577 0.548 . . . . 0.0 109.625 173.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.423 HG23 HD22 ' A' ' 49' ' ' LEU . 75.3 mt -61.22 -57.75 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.75 0.82 . . . . 0.0 111.428 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.527 HD21 HD12 ' A' ' 30' ' ' LEU . 9.9 mp -66.26 -29.61 69.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.626 0.37 . . . . 0.0 110.59 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.491 ' HA2' HD21 ' A' ' 17' ' ' LEU . . . -66.7 -29.07 74.15 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 119.912 -0.382 . . . . 0.0 113.003 172.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.18 -48.63 17.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.44 0.696 . . . . 0.0 110.557 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.6 t -66.58 -56.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.526 0.731 . . . . 0.0 110.293 -174.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.563 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -84.54 -2.37 57.24 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.95 0.5 . . . . 0.0 110.982 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 58.0 t30 60.77 50.88 5.13 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.636 1.174 . . . . 0.0 111.533 170.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.491 HD21 ' HA2' ' A' ' 12' ' ' GLY . 2.7 mm? -72.69 -34.05 66.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.943 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.67 -90.7 0.25 Allowed Glycine 0 C--N 1.348 1.223 0 O-C-N 123.486 0.491 . . . . 0.0 112.772 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -94.01 -23.16 18.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.622 0.769 . . . . 0.0 111.012 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -68.32 -29.13 67.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.453 ' O ' ' HD2' ' A' ' 8' ' ' ARG . 9.5 pttm -69.89 -29.89 67.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.453 0.301 . . . . 0.0 111.017 173.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -75.52 -35.49 60.73 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.181 0.592 . . . . 0.0 110.775 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.4 HG23 ' HA ' ' A' ' 20' ' ' ARG . 11.2 t -83.49 -22.33 32.55 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.938 0.495 . . . . 0.0 111.67 -174.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -82.45 143.77 30.92 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.4 p -118.98 -174.47 2.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.765 1.226 . . . . 0.0 110.225 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.41 88.8 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.292 0.567 . . . . 0.0 111.213 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 m -84.57 3.85 34.84 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.859 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.0 t -95.31 151.31 19.37 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.676 0.79 . . . . 0.0 110.16 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -87.14 148.79 4.38 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.162 1.385 . . . . 0.0 110.183 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.527 HD12 HD21 ' A' ' 11' ' ' LEU . 70.3 mt -114.72 -68.46 0.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.278 0.631 . . . . 0.0 109.737 175.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.66 112.54 2.29 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.518 0.727 . . . . 0.0 109.256 176.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.37 -40.38 2.5 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 123.615 0.572 . . . . 0.0 112.292 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -83.12 -34.64 26.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.382 0.673 . . . . 0.0 110.835 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.442 HG23 HD13 ' A' ' 17' ' ' LEU . 34.7 mm -87.97 117.16 68.13 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 173.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.27 0.27 10.16 Favored 'Trans proline' 0 C--N 1.369 1.623 0 C-N-CA 122.711 2.274 . . . . 0.0 112.562 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 10.9 mm-40 -95.08 -18.03 21.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.909 0.884 . . . . 0.0 109.947 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -81.45 92.54 6.47 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -107.12 -164.75 1.01 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.192 0.997 . . . . 0.0 111.068 176.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.562 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.0 t -49.6 -69.3 0.12 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.294 1.838 . . . . 0.0 112.953 176.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.8 mmm -68.84 -19.06 64.25 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.895 -0.503 . . . . 0.0 111.233 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.563 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -65.82 -43.3 89.0 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-O 118.706 -0.664 . . . . 0.0 111.538 174.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' ' 39' ' ' SER . 4.5 m -61.43 -38.22 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.38 -47.33 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.964 -176.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -61.51 -40.47 94.72 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.017 -1.447 . . . . 0.0 112.445 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.406 ' O ' HD21 ' A' ' 49' ' ' LEU . 31.0 m -77.38 -31.22 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.13 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.526 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.8 mt -61.76 -54.05 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.454 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 71.7 m -58.62 -39.5 80.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 124.807 1.317 . . . . 0.0 111.357 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -48.1 83.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.601 0.76 . . . . 0.0 111.195 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.423 HD22 HG23 ' A' ' 10' ' ' ILE . 3.8 mm? -53.73 -46.32 70.81 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.432 0.693 . . . . 0.0 110.496 174.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.2 mm-40 -55.03 -46.82 75.31 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 124.172 0.92 . . . . 0.0 111.016 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 47' ' ' THR . 16.0 mm-40 -70.5 -52.16 23.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.109 -174.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -68.93 -35.03 76.33 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -97.48 -6.58 33.44 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 64.34 36.9 8.8 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.329 1.052 . . . . 0.0 112.076 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -132.83 -175.48 3.79 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.711 0.404 . . . . 0.0 110.642 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.76 127.64 33.2 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 122.626 0.37 . . . . 0.0 110.917 172.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.22 129.9 36.68 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' HG13 ' A' ' 62' ' ' ILE . 21.5 t70 -77.16 148.52 35.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.101 0.56 . . . . 0.0 110.37 -175.044 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.48 -43.21 71.53 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.137 0.975 . . . . 0.0 112.288 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.87 -12.06 61.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.838 0.855 . . . . 0.0 113.015 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -107.47 -15.74 14.54 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 117.918 0.326 . . . . 0.0 110.909 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 58' ' ' ASP . 52.3 mt -74.98 106.53 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 173.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.8 t -126.48 171.28 11.18 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.634 1.173 . . . . 0.0 109.346 173.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.08 -26.7 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 121.137 0.494 . . . . 0.0 109.95 168.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -70.37 -10.7 59.77 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.053 0.941 . . . . 0.0 111.488 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.46 HG23 HD13 ' A' ' 73' ' ' LEU . 56.1 m -72.46 -38.1 68.33 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.907 0.483 . . . . 0.0 109.802 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.526 ' HA ' HD21 ' A' ' 73' ' ' LEU . 74.6 m-85 -99.11 9.24 43.88 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -175.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.18 -44.86 96.63 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.246 0.341 . . . . 0.0 110.921 -176.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 49.6 p -137.28 159.6 41.45 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.923 0.889 . . . . 0.0 110.225 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.96 -34.17 72.91 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 123.871 0.732 . . . . 0.0 111.127 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.27 -40.39 98.53 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 124.518 1.136 . . . . 0.0 112.194 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.41 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 38.9 m -60.84 -50.74 72.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.32 0.648 . . . . 0.0 110.845 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.526 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -58.0 -45.24 87.14 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 123.257 0.348 . . . . 0.0 110.492 176.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.599 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.49 -44.1 80.32 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 124.667 1.229 . . . . 0.0 110.392 -179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.2 -52.0 64.74 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.422 1.076 . . . . 0.0 110.277 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.464 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 31.6 m-85 -54.91 -58.97 5.46 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.118 0.886 . . . . 0.0 110.966 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 73' ' ' LEU . 29.5 m -66.4 -24.08 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.416 0.686 . . . . 0.0 112.791 -176.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 63.3 mm-40 -59.97 -52.13 66.73 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 169.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -65.5 -41.61 93.03 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.012 -172.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 27.7 mmmt -73.63 -43.93 58.29 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 123.762 0.663 . . . . 0.0 111.741 -172.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.87 -17.01 56.31 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 122.673 0.389 . . . . 0.0 111.548 -177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.975 0.417 . . . . 0.0 111.285 174.747 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -36.43 9.92 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.39 1.076 . . . . 0.0 110.739 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -75.74 -12.25 60.15 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.05 0.94 . . . . 0.0 112.941 -168.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -54.91 -30.93 59.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.844 0.715 . . . . 0.0 111.872 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.44 -44.76 70.63 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.885 0.874 . . . . 0.0 110.709 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.423 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.09 -32.06 69.94 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 177.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.69 -47.58 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 122.963 0.505 . . . . 0.0 109.93 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.52 ' HA ' HD13 ' A' ' 11' ' ' LEU . 31.4 ptt180 -68.08 -29.94 69.01 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.383 0.427 . . . . 0.0 109.999 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.569 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.4 t30 -60.89 -46.31 91.15 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.473 0.709 . . . . 0.0 110.025 174.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.47 HG23 HD21 ' A' ' 49' ' ' LEU . 86.1 mt -60.83 -44.8 98.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.418 176.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.52 HD13 ' HA ' ' A' ' 8' ' ' ARG . 39.9 mt -62.14 -38.17 87.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.061 0.544 . . . . 0.0 111.066 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.565 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -73.34 -25.91 71.68 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.145 -0.48 . . . . 0.0 113.481 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.35 -51.3 17.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.649 0.78 . . . . 0.0 110.554 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.7 t -77.18 -55.32 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.669 -173.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.453 HD12 HD11 ' A' ' 37' ' ' LEU . 33.7 mt -84.02 -4.12 58.51 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.966 -171.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 68.16 44.46 1.41 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 124.694 1.197 . . . . 0.0 111.474 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.565 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 9.9 mp -73.61 -36.31 65.47 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.298 174.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 65.6 -87.1 0.09 OUTLIER Glycine 0 C--N 1.354 1.549 0 O-C-N 123.829 0.706 . . . . 0.0 112.659 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.23 -28.14 19.05 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.52 0.728 . . . . 0.0 111.123 177.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.481 HH11 HD22 ' A' ' 24' ' ' LEU . 2.0 tmt_? -67.31 -22.92 65.61 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.937 0.895 . . . . 0.0 110.411 -173.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.3 pttt -67.25 -29.29 68.88 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.028 0.531 . . . . 0.0 111.139 176.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -95.09 -18.96 20.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.452 0.701 . . . . 0.0 110.658 -173.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.413 HG23 ' O ' ' A' ' 20' ' ' ARG . 5.9 t -81.43 -10.98 59.4 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.732 0.413 . . . . 0.0 111.121 176.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.481 HD22 HH11 ' A' ' 20' ' ' ARG . 4.1 pp -102.66 152.8 20.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.813 0.445 . . . . 0.0 110.571 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.7 p -122.97 -171.63 2.33 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.485 1.114 . . . . 0.0 110.095 -174.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.73 67.57 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.308 0.643 . . . . 0.0 112.357 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.1 m -74.86 -26.71 59.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.614 0.766 . . . . 0.0 112.171 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 86.5 p -63.28 131.48 48.49 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 122.938 0.495 . . . . 0.0 111.34 -172.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.03 149.17 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.488 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.2 mt -111.17 -67.9 0.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.6 mt -57.92 112.13 1.39 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.601 0.36 . . . . 0.0 110.328 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 99.1 -28.93 13.01 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 115.426 -0.806 . . . . 0.0 113.569 177.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -88.62 -47.48 8.25 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 117.254 0.527 . . . . 0.0 110.63 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.488 HG12 ' HA ' ' A' ' 30' ' ' LEU . 27.9 mm -76.25 115.74 49.78 Favored Pre-proline 0 N--CA 1.472 0.64 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 177.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.91 -5.14 16.43 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 122.381 2.054 . . . . 0.0 112.856 -174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -107.13 -0.24 22.95 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.461 0.704 . . . . 0.0 110.911 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.453 HD11 HD12 ' A' ' 15' ' ' LEU . 39.1 tp -94.74 80.29 3.76 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.466 0.65 . . . . 0.0 109.529 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.401 ' O ' HG11 ' A' ' 42' ' ' VAL . 3.8 p30 -95.97 -165.88 1.35 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.273 1.029 . . . . 0.0 110.275 176.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.555 ' O ' HG21 ' A' ' 42' ' ' VAL . 35.5 t -52.98 -69.58 0.11 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 125.391 1.476 . . . . 0.0 113.05 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 15.5 mmt -66.0 -23.84 66.65 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.793 -0.567 . . . . 0.0 111.388 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.63 83.6 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 175.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.555 HG21 ' O ' ' A' ' 39' ' ' SER . 15.1 m -66.99 -35.75 75.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.549 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 t -65.0 -41.42 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 121.503 0.668 . . . . 0.0 110.701 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -61.93 -46.96 87.04 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 114.445 -1.252 . . . . 0.0 112.089 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.1 m -70.16 -28.99 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 CA-C-O 119.194 -0.431 . . . . 0.0 111.669 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 84.2 mt -59.0 -55.51 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.408 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 52.3 m -57.62 -42.46 83.34 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.918 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -38.77 90.89 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.941 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.47 HD21 HG23 ' A' ' 10' ' ' ILE . 2.4 mm? -56.98 -48.51 78.24 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.8 mm-40 -52.09 -50.91 60.69 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.491 1.119 . . . . 0.0 110.656 177.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 47' ' ' THR . 61.8 mm-40 -63.66 -58.12 7.91 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.642 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -69.47 -35.54 75.7 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -170.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -89.89 -13.6 36.02 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.13 49.18 2.74 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.088 0.955 . . . . 0.0 111.357 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -143.49 -169.48 3.07 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.087 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.0 t -138.01 131.26 30.45 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.959 0.503 . . . . 0.0 110.664 172.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.0 t -90.89 129.97 40.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 168.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.445 ' O ' HG13 ' A' ' 62' ' ' ILE . 36.2 t70 -74.79 148.39 40.39 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -65.84 -28.41 68.96 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.606 0.363 . . . . 0.0 111.789 -174.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.08 -29.25 66.2 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.71 0.804 . . . . 0.0 111.109 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -94.14 -13.48 26.69 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 122.623 0.369 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 58' ' ' ASP . 61.7 mt -75.7 107.82 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 172.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.5 t -115.7 167.31 11.03 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.933 0.893 . . . . 0.0 109.636 173.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.24 -31.83 73.18 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 165.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -71.26 -10.98 60.65 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.449 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.472 HG23 HD13 ' A' ' 73' ' ' LEU . 41.1 m -79.21 -41.38 28.44 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.52 ' HA ' HD23 ' A' ' 73' ' ' LEU . 43.2 m-85 -99.0 11.95 37.44 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.711 0.804 . . . . 0.0 113.048 -174.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.542 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.4 pt-20 -61.22 -44.62 96.98 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.294 0.638 . . . . 0.0 111.749 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.542 HG22 ' HG3' ' A' ' 68' ' ' GLU . 8.0 t -148.0 158.68 44.18 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 110.229 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.37 -35.89 70.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.572 0.749 . . . . 0.0 111.434 -178.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.87 -42.07 96.47 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.492 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -63.95 -47.31 80.96 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.295 0.638 . . . . 0.0 111.44 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.52 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -57.53 -45.03 85.5 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.563 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.49 -44.79 89.54 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.835 1.334 . . . . 0.0 110.899 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -58.73 -51.12 71.33 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 123.972 0.795 . . . . 0.0 110.645 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.503 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 22.7 m-85 -56.08 -55.34 34.17 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.74 -24.97 31.6 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 123.055 0.542 . . . . 0.0 111.774 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.3 mm-40 -56.49 -56.88 15.71 Favored 'General case' 0 C--N 1.365 1.248 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -59.85 -46.35 89.55 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.196 0.935 . . . . 0.0 111.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.7 mmmt -57.97 -55.81 30.1 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.365 1.066 . . . . 0.0 112.034 -176.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.29 -13.71 59.73 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.876 -175.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.482 1.137 0 CA-C-N 117.953 0.342 . . . . 0.0 111.445 173.304 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.586 ' HE2' HD22 ' A' ' 75' ' ' LEU . 1.9 tpt . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.99 -36.74 65.73 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -163.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG21 ' A' ' 7' ' ' VAL . 11.0 m-70 -73.5 -9.31 58.56 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.412 -173.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.7 -32.62 59.75 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.133 0.573 . . . . 0.0 110.166 173.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.56 -52.03 43.54 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.466 -176.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.461 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.32 -35.01 75.51 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.14 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 3' ' ' HIS . 97.5 t -66.18 -47.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 122.585 0.354 . . . . 0.0 110.361 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.463 ' HA ' HD13 ' A' ' 11' ' ' LEU . 36.2 ptt180 -69.88 -27.18 64.6 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.646 0.378 . . . . 0.0 110.431 -178.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -61.63 -45.66 93.12 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.222 173.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 6' ' ' ALA . 92.8 mt -64.09 -46.33 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.58 1.152 . . . . 0.0 111.508 177.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.463 HD13 ' HA ' ' A' ' 8' ' ' ARG . 52.1 mt -61.58 -43.03 99.61 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.321 0.648 . . . . 0.0 110.966 -177.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.11 -19.14 77.66 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.056 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -75.09 -42.18 57.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 110.232 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 79.9 t -83.14 -46.23 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.26 -172.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.43 HD11 ' HB2' ' A' ' 41' ' ' ALA . 1.8 mm? -99.02 1.07 45.06 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.896 0.478 . . . . 0.0 111.991 -177.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.7 t30 60.05 63.19 1.48 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.86 1.264 . . . . 0.0 111.367 173.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.476 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 10.0 mp -81.49 -29.67 33.58 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.764 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.77 -105.94 1.85 Allowed Glycine 0 C--N 1.348 1.215 0 O-C-N 123.555 0.535 . . . . 0.0 112.35 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.6 -24.23 36.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.261 0.624 . . . . 0.0 110.443 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.552 HH11 HD22 ' A' ' 24' ' ' LEU . 2.3 tmt_? -64.78 -35.4 80.98 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.654 0.781 . . . . 0.0 109.66 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 52.6 pttt -67.08 -23.34 65.84 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.525 0.515 . . . . 0.0 111.549 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -94.59 -42.72 8.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 122.634 0.374 . . . . 0.0 110.724 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.51 HG22 ' HA ' ' A' ' 20' ' ' ARG . 14.5 t -75.51 3.96 8.38 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.489 0.716 . . . . 0.0 112.43 -172.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.552 HD22 HH11 ' A' ' 20' ' ' ARG . 3.1 pp -95.97 -179.79 4.81 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.758 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 45.3 p -133.12 -171.94 2.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.564 1.146 . . . . 0.0 109.124 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.1 66.3 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.45 0.7 . . . . 0.0 111.728 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.5 m -75.61 -5.42 45.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.984 0.914 . . . . 0.0 111.997 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 29.2 t -71.0 130.47 41.66 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.928 0.491 . . . . 0.0 110.674 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.0 t -87.13 138.43 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.45 ' HA ' HG12 ' A' ' 34' ' ' ILE . 59.6 mt -105.62 -71.58 0.74 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.892 0.477 . . . . 0.0 111.304 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.4 HD22 HD22 ' A' ' 37' ' ' LEU . 71.1 mt -53.96 118.98 4.43 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 123.705 0.628 . . . . 0.0 111.02 177.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.43 -41.65 3.1 Favored Glycine 0 C--N 1.342 0.869 0 O-C-N 123.967 0.792 . . . . 0.0 113.401 177.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -72.14 -48.63 42.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.655 0.782 . . . . 0.0 111.19 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.45 HG12 ' HA ' ' A' ' 30' ' ' LEU . 35.3 mm -73.69 116.99 57.21 Favored Pre-proline 0 CA--C 1.545 0.758 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -74.15 -0.24 9.33 Favored 'Trans proline' 0 C--N 1.369 1.653 0 C-N-CA 122.8 2.333 . . . . 0.0 113.224 -175.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -107.93 -2.4 19.81 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.915 0.886 . . . . 0.0 110.525 178.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.4 HD22 HD22 ' A' ' 31' ' ' LEU . 3.7 tt -106.19 102.59 11.99 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -175.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -112.48 -164.53 0.92 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.487 1.115 . . . . 0.0 110.583 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.53 ' O ' HG23 ' A' ' 42' ' ' VAL . 45.0 t -45.38 -67.67 0.26 Allowed 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 126.668 1.987 . . . . 0.0 113.231 171.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 22.3 mmt -62.48 -25.97 68.28 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.032 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.43 ' HB2' HD11 ' A' ' 15' ' ' LEU . . . -64.99 -38.69 91.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 118.874 -0.584 . . . . 0.0 112.276 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 39' ' ' SER . 2.5 m -61.11 -38.45 79.66 Favored 'Isoleucine or valine' 0 C--N 1.368 1.406 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 176.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.6 t -69.58 -45.43 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.771 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -57.59 -42.72 83.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.124 -1.398 . . . . 0.0 112.077 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.2 m -78.91 -28.03 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.492 -0.766 . . . . 0.0 112.175 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.489 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.6 mt -59.83 -55.59 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 171.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 30.1 m -54.52 -48.7 71.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.921 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.07 99.12 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.057 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -54.87 -51.66 65.25 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.283 0.633 . . . . 0.0 109.831 175.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.8 mm-40 -54.01 -44.2 70.7 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.471 1.108 . . . . 0.0 111.181 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 47' ' ' THR . 13.1 mm-40 -63.25 -64.15 0.99 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.71 -179.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -61.98 -41.43 98.01 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.703 0.801 . . . . 0.0 113.049 -170.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -88.0 -21.32 24.89 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 118.962 -0.542 . . . . 0.0 112.016 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 63.88 58.95 1.17 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.18 0.992 . . . . 0.0 111.113 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -147.38 -177.19 5.56 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.003 -0.998 . . . . 0.0 109.749 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.2 t -131.1 117.9 19.77 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.531 0.333 . . . . 0.0 111.014 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.6 t -76.8 124.89 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 168.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 34.1 t70 -65.6 135.92 55.68 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.597 0.359 . . . . 0.0 110.315 -176.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -60.83 -27.58 68.18 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.243 0.617 . . . . 0.0 112.037 -173.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -82.07 -19.0 41.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.302 0.641 . . . . 0.0 112.272 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -92.29 -19.67 21.91 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 176.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 58' ' ' ASP . 57.7 mt -72.84 113.51 10.58 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.2 t -129.5 175.62 8.64 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 125.066 1.346 . . . . 0.0 108.389 175.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.45 -30.24 70.55 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 168.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -72.57 -13.6 61.43 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.603 0.761 . . . . 0.0 111.758 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 49.5 m -78.31 -32.42 49.27 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.054 0.542 . . . . 0.0 109.625 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.455 ' HA ' HD22 ' A' ' 73' ' ' LEU . 59.1 m-85 -108.94 7.16 25.83 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.633 0.773 . . . . 0.0 112.998 -177.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.96 -40.53 95.14 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 117.655 0.207 . . . . 0.0 111.043 -176.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.7 p -135.65 163.86 29.18 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.727 0.811 . . . . 0.0 110.241 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.48 -35.83 78.76 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.582 173.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.42 -30.99 75.79 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.026 0.829 . . . . 0.0 112.68 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.4 m -67.92 -51.73 44.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.353 0.661 . . . . 0.0 110.458 176.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.455 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.92 -46.99 86.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 122.915 0.134 . . . . 0.0 110.864 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -52.74 -50.39 63.55 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.596 1.185 . . . . 0.0 109.742 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.586 HD22 ' HE2' ' A' ' 1' ' ' MET . 0.2 OUTLIER -54.32 -56.48 18.09 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.582 1.153 . . . . 0.0 110.426 -179.007 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.4 m-85 -57.21 -54.76 43.08 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.95 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 17.2 m -67.79 -25.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.048 0.539 . . . . 0.0 111.616 -176.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.517 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 69.1 mm-40 -60.56 -46.65 89.42 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 171.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -59.03 -50.74 72.94 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 123.518 0.511 . . . . 0.0 110.665 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -63.48 -50.99 67.5 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.715 -170.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.12 -13.93 60.9 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.155 0.582 . . . . 0.0 112.157 -177.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.48 1.032 0 C-N-CA 122.69 0.396 . . . . 0.0 111.553 172.543 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.22 0.533 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.24 -34.48 10.32 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.096 0.959 . . . . 0.0 110.394 170.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.4 ' O ' HG22 ' A' ' 7' ' ' VAL . 15.7 m-70 -75.06 -20.05 59.72 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -53.71 -28.95 36.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 123.57 0.543 . . . . 0.0 111.898 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -65.26 -48.38 73.41 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 123.514 0.726 . . . . 0.0 111.083 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.13 -30.81 62.48 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.169 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 3' ' ' HIS . 91.7 t -65.08 -46.6 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 39.6 ptt180 -74.56 -24.89 59.0 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.988 0.515 . . . . 0.0 110.641 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.453 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 48.7 t30 -61.45 -47.04 87.55 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 172.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 93.6 mt -62.35 -45.66 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.955 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.41 -42.9 98.76 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.797 0.439 . . . . 0.0 110.961 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.496 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -70.58 -18.93 76.01 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.206 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -81.85 -52.49 7.05 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.053 0.541 . . . . 0.0 111.161 174.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.9 t -68.05 -57.99 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.321 0.648 . . . . 0.0 109.84 -175.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 41' ' ' ALA . 2.0 mm? -81.21 -10.93 59.53 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 123.649 0.593 . . . . 0.0 111.272 -176.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 66.65 47.94 1.51 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.454 1.102 . . . . 0.0 110.868 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.411 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 3.5 mm? -66.53 -34.38 77.79 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 171.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.95 -93.27 0.15 Allowed Glycine 0 C--N 1.355 1.588 0 O-C-N 123.938 0.774 . . . . 0.0 112.988 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -79.19 -34.52 42.95 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.353 1.061 . . . . 0.0 110.413 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HA ' HG21 ' A' ' 23' ' ' THR . 1.7 tmt_? -68.58 -25.34 64.84 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.577 -171.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.496 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 56.1 pttt -64.98 -29.06 69.96 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.476 0.179 . . . . 0.0 111.33 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -85.53 -29.9 23.84 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 122.864 0.465 . . . . 0.0 110.982 -175.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.455 HG21 ' HA ' ' A' ' 20' ' ' ARG . 12.1 t -84.37 -9.86 58.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.045 0.538 . . . . 0.0 111.819 -176.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 pp -94.22 151.79 19.19 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 177.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.0 p -112.67 -173.54 2.27 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.809 0.844 . . . . 0.0 109.938 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 -23.62 66.11 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.042 0.537 . . . . 0.0 111.332 172.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.3 m -81.16 0.98 33.93 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.26 1.024 . . . . 0.0 112.734 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.7 t -81.94 137.7 35.12 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.653 0.381 . . . . 0.0 110.651 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -86.91 145.76 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 124.331 1.052 . . . . 0.0 109.188 175.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.4 mt -108.18 -70.68 0.79 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.233 0.613 . . . . 0.0 110.676 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.461 HD22 HD12 ' A' ' 37' ' ' LEU . 21.4 mt -51.3 113.99 1.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.243 1.017 . . . . 0.0 112.269 178.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.49 -27.93 4.03 Favored Glycine 0 C--N 1.348 1.202 0 O-C-N 123.942 0.777 . . . . 0.0 114.059 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -76.7 -59.74 2.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.319 0.648 . . . . 0.0 109.915 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.421 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 43.9 mm -70.84 121.98 85.49 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 173.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -69.37 -9.22 25.67 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 122.653 2.235 . . . . 0.0 112.452 -175.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 16.6 mm-40 -94.48 -21.87 18.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.831 0.853 . . . . 0.0 110.528 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -82.45 80.77 8.52 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -174.191 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -112.55 -168.45 1.32 Allowed 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 125.204 1.402 . . . . 0.0 109.516 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.538 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.2 t -51.06 -70.42 0.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 125.751 1.621 . . . . 0.0 114.486 -173.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.8 mmm -65.0 -22.06 66.94 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.632 -0.667 . . . . 0.0 111.251 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.493 ' HB2' HD13 ' A' ' 15' ' ' LEU . . . -67.07 -35.96 80.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.481 0.713 . . . . 0.0 111.932 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -64.54 -37.9 81.24 Favored 'Isoleucine or valine' 0 C--N 1.372 1.545 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.1 t -67.66 -44.33 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.684 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -61.7 -38.85 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.132 -1.394 . . . . 0.0 112.532 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.409 ' O ' HD21 ' A' ' 49' ' ' LEU . 30.1 m -80.1 -29.15 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.097 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.543 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -59.8 -57.06 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 171.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.9 m -55.72 -44.39 77.43 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.624 1.202 . . . . 0.0 111.37 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.49 -47.79 84.13 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.003 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.409 HD21 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -52.17 -49.75 63.18 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.424 0.69 . . . . 0.0 110.174 174.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.9 mm-40 -57.47 -43.25 83.89 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.994 0.918 . . . . 0.0 111.368 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -67.08 -52.45 41.93 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.785 0.834 . . . . 0.0 112.59 -176.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -69.57 -39.35 77.42 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -91.03 -16.8 27.32 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 57.97 64.27 1.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 124.611 1.164 . . . . 0.0 111.11 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -149.24 -176.36 5.34 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.679 0.792 . . . . 0.0 109.622 178.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -134.89 116.73 15.08 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 122.357 0.263 . . . . 0.0 111.421 171.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.557 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.8 t -69.34 127.85 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 168.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.459 ' O ' HG13 ' A' ' 62' ' ' ILE . 32.0 t70 -72.41 142.86 48.68 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 118.142 0.428 . . . . 0.0 110.767 -173.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -50.3 -44.65 54.1 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.521 1.128 . . . . 0.0 112.592 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.7 -21.76 64.39 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.107 -174.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -97.98 -20.97 17.09 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.157 0.183 . . . . 0.0 110.909 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 58' ' ' ASP . 60.9 mt -75.47 117.48 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 0.0 110.264 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 t -144.37 179.59 7.15 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 124.117 0.967 . . . . 0.0 109.491 174.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.7 74.02 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.71 0.804 . . . . 0.0 110.151 167.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -67.84 -17.15 64.41 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -81.11 -37.82 28.27 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.453 0.701 . . . . 0.0 110.024 174.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.467 ' HA ' HD23 ' A' ' 73' ' ' LEU . 39.2 m-85 -104.85 14.7 29.11 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.28 0.632 . . . . 0.0 112.402 -176.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.54 -46.14 89.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.65 0.38 . . . . 0.0 110.605 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.3 p -137.28 158.41 44.49 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.638 0.775 . . . . 0.0 110.43 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.3 tp -55.41 -39.72 70.56 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.504 0.722 . . . . 0.0 110.71 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.46 95.76 Favored Glycine 0 C--N 1.347 1.176 0 O-C-N 124.452 1.095 . . . . 0.0 112.474 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -60.09 -45.31 93.38 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 122.787 0.435 . . . . 0.0 110.978 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.86 -42.18 99.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 122.999 0.187 . . . . 0.0 110.759 175.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.553 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.16 -49.03 79.42 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 124.153 0.908 . . . . 0.0 111.03 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.84 -43.74 92.07 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.634 0.774 . . . . 0.0 110.696 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.508 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 7.1 m-85 -58.08 -52.0 67.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 119.235 -0.412 . . . . 0.0 110.587 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.3 m -70.88 -24.73 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.003 0.521 . . . . 0.0 111.975 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 78.6 mm-40 -56.71 -44.85 81.99 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 168.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -73.19 -39.42 65.6 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.307 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 57' ' ' VAL . 32.5 mmmt -64.91 -53.0 53.39 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.481 0.712 . . . . 0.0 111.912 -173.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.07 -13.1 60.45 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.436 -177.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 123.78 0.832 . . . . 0.0 111.845 172.472 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.618 0.247 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -98.02 -37.82 9.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.009 0.923 . . . . 0.0 110.323 172.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -75.14 -12.98 60.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.992 0.917 . . . . 0.0 113.102 -169.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -57.67 -22.13 44.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 123.541 0.526 . . . . 0.0 111.689 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.3 -58.98 6.18 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.265 1.026 . . . . 0.0 110.926 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.66 58.82 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.783 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 87.4 t -63.53 -54.84 27.41 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -69.28 -28.04 65.95 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.289 0.236 . . . . 0.0 110.516 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -60.1 -52.57 64.77 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.319 0.647 . . . . 0.0 109.906 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.402 HG23 HD21 ' A' ' 49' ' ' LEU . 92.6 mt -64.05 -51.9 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.997 -178.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.407 HD12 HD13 ' A' ' 30' ' ' LEU . 76.7 mt -61.05 -39.63 90.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.074 0.55 . . . . 0.0 111.59 -175.036 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.535 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.1 -23.94 70.24 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 121.329 -0.462 . . . . 0.0 113.366 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.34 -27.01 38.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.033 0.533 . . . . 0.0 110.915 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.2 t -86.28 -59.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.336 0.655 . . . . 0.0 109.644 177.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.451 HD13 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -77.38 3.77 12.42 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -174.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 71.5 38.01 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.293 1.037 . . . . 0.0 111.192 167.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.411 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.6 mp -75.78 -32.08 59.77 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.165 172.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.5 -95.9 0.27 Allowed Glycine 0 C--N 1.353 1.51 0 O-C-N 123.556 0.535 . . . . 0.0 113.224 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -90.11 -25.29 20.8 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.025 0.93 . . . . 0.0 110.897 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.436 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.11 -26.82 69.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.574 0.749 . . . . 0.0 111.348 -175.523 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.535 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.8 pttt -66.26 -30.32 70.73 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.041 0.537 . . . . 0.0 111.731 178.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -81.91 -22.3 36.87 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.513 0.725 . . . . 0.0 111.081 -175.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 t -93.49 2.62 56.38 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.836 0.454 . . . . 0.0 112.054 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.436 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -108.06 159.06 16.87 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.951 -0.468 . . . . 0.0 110.743 176.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -116.26 -174.92 2.64 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.663 0.785 . . . . 0.0 110.915 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -67.3 -17.69 64.88 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.28 0.632 . . . . 0.0 111.933 175.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -74.23 -24.03 59.25 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.34 0.656 . . . . 0.0 111.46 173.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.1 t -63.54 125.43 24.22 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.712 0.805 . . . . 0.0 111.455 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.8 t -79.23 147.14 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.407 HD13 HD12 ' A' ' 11' ' ' LEU . 67.5 mt -116.43 -68.14 0.94 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.241 0.616 . . . . 0.0 110.07 -177.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 tt -61.86 111.23 1.8 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.54 -26.95 22.67 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.461 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -88.92 -49.89 6.52 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 117.321 0.56 . . . . 0.0 110.671 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.4 mm -81.35 118.48 72.46 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.93 -6.68 18.4 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.686 2.257 . . . . 0.0 112.848 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -94.24 -18.14 21.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.88 0.872 . . . . 0.0 111.06 -175.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.5 tp -86.66 88.52 7.68 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 122.917 0.487 . . . . 0.0 109.719 -174.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.415 ' H ' ' HB2' ' A' ' 41' ' ' ALA . 13.0 t70 -120.76 -170.68 2.04 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.045 0.938 . . . . 0.0 109.66 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.512 ' O ' HG21 ' A' ' 42' ' ' VAL . 38.1 t -40.27 -69.4 0.13 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 127.615 2.366 . . . . 0.0 114.883 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -66.89 -29.76 69.74 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.211 -0.931 . . . . 0.0 111.761 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.451 ' HB1' HD13 ' A' ' 15' ' ' LEU . . . -66.79 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' ' 39' ' ' SER . 28.6 m -70.42 -33.32 53.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.2 -46.79 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.509 0.671 . . . . 0.0 110.033 175.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -56.68 -48.71 77.04 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.27 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.449 HG21 ' HA ' ' A' ' 42' ' ' VAL . 27.6 m -72.45 -32.9 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.915 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.522 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -60.01 -52.26 63.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.3 m -55.06 -44.61 74.93 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 124.579 1.175 . . . . 0.0 111.177 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -42.35 99.66 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.763 0.825 . . . . 0.0 111.883 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.402 HD21 HG23 ' A' ' 10' ' ' ILE . 3.7 mm? -57.82 -46.29 84.92 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.071 0.548 . . . . 0.0 110.232 173.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.8 mm-40 -54.46 -44.18 72.33 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.232 1.013 . . . . 0.0 110.827 178.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 47' ' ' THR . 43.4 mm-40 -63.01 -57.18 11.56 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.724 -176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -66.35 -44.91 81.93 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.604 0.565 . . . . 0.0 112.258 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -88.56 -9.46 52.21 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 118.941 -0.552 . . . . 0.0 112.359 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 59.47 45.28 13.78 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.271 1.028 . . . . 0.0 111.656 175.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -139.02 -177.02 4.7 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.425 -174.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.7 t -134.49 113.66 12.05 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.2 t -69.06 131.91 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.501 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 16.9 t70 -67.37 134.04 50.73 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.46 0.704 . . . . 0.0 110.158 -176.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -57.98 -38.42 76.05 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.886 0.875 . . . . 0.0 112.949 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -72.35 -20.18 61.51 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.938 0.495 . . . . 0.0 111.995 -176.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 18.3 pt-20 -98.71 -8.92 25.34 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.382 0.273 . . . . 0.0 110.641 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 51.5 mt -87.09 117.81 31.94 Favored 'Isoleucine or valine' 0 C--N 1.359 0.979 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.8 t -155.91 -172.3 4.07 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.308 1.043 . . . . 0.0 108.459 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.85 77.75 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.719 0.408 . . . . 0.0 110.655 176.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.1 mm-40 -68.55 -12.26 61.04 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.149 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.474 HG22 HD12 ' A' ' 73' ' ' LEU . 23.2 m -81.29 -45.14 16.66 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.215 0.606 . . . . 0.0 109.606 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.495 ' HA ' HD21 ' A' ' 73' ' ' LEU . 70.0 m-85 -97.75 6.25 48.14 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -174.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.486 ' HG3' HG23 ' A' ' 69' ' ' THR . 8.7 pt-20 -57.03 -45.13 83.33 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.724 0.64 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.486 HG23 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -146.63 160.21 42.46 Favored 'General case' 0 C--O 1.249 1.058 0 C-N-CA 123.466 0.707 . . . . 0.0 110.036 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 17.3 tp -58.84 -35.66 73.27 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.774 0.83 . . . . 0.0 110.852 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.82 -42.14 96.4 Favored Glycine 0 C--N 1.349 1.276 0 O-C-N 124.635 1.209 . . . . 0.0 112.107 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.5 m -62.58 -49.45 75.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.974 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -57.69 -46.22 84.61 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.137 0.426 . . . . 0.0 110.196 178.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.556 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.46 -39.37 90.65 Favored 'General case' 0 C--O 1.217 -0.65 0 O-C-N 124.529 1.143 . . . . 0.0 111.305 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.78 -49.68 67.47 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.733 0.813 . . . . 0.0 110.621 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 42.4 m-85 -55.72 -49.67 72.42 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.55 0.531 . . . . 0.0 110.32 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.2 m -70.73 -25.66 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -55.69 -48.81 74.48 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -66.9 -41.27 87.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.146 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -63.2 -54.1 42.84 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.65 0.78 . . . . 0.0 112.238 -173.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.44 -13.5 61.08 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.328 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 123.422 0.689 . . . . 0.0 111.45 174.092 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.61 ' SD ' ' HG3' ' A' ' 78' ' ' GLU . 7.1 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . 0.406 ' N ' HE21 ' A' ' 2' ' ' GLN . 0.0 OUTLIER -98.23 -39.32 8.91 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 0.0 111.724 -175.21 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' HG22 ' A' ' 7' ' ' VAL . 41.7 m-70 -76.8 -10.97 59.75 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.24 -170.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -55.35 -31.88 62.08 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 118.664 0.666 . . . . 0.0 111.799 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.72 -41.54 59.98 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.447 0.699 . . . . 0.0 111.435 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.27 -37.22 83.09 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.959 176.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -67.1 -47.3 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.052 178.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.415 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 28.7 ptt180 -68.65 -25.93 65.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.563 0.345 . . . . 0.0 110.476 -179.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 23.8 t30 -61.86 -50.49 72.02 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.67 0.788 . . . . 0.0 109.531 173.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.549 HG23 HD21 ' A' ' 49' ' ' LEU . 91.5 mt -59.83 -42.72 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.651 1.18 . . . . 0.0 111.281 178.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 46.0 mt -68.96 -41.75 77.54 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.136 0.574 . . . . 0.0 111.056 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.442 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -71.91 -18.27 77.51 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 116.147 -0.478 . . . . 0.0 113.148 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -79.95 -53.75 6.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.848 0.859 . . . . 0.0 110.006 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.49 HG12 ' ND2' ' A' ' 44' ' ' ASN . 79.5 t -73.32 -49.54 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.09 0.956 . . . . 0.0 111.387 -173.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 0.9 OUTLIER -83.93 -3.09 57.69 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.269 0.228 . . . . 0.0 110.84 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 61.64 53.45 3.26 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 124.962 1.305 . . . . 0.0 111.214 172.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.433 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.8 mp -75.81 -28.16 58.22 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.8 171.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.46 -89.03 0.08 OUTLIER Glycine 0 C--N 1.353 1.491 0 O-C-N 124.211 0.944 . . . . 0.0 112.408 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -93.24 -29.34 15.74 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.827 0.851 . . . . 0.0 111.448 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.68 -26.35 66.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.99 0.516 . . . . 0.0 111.355 -170.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 58.1 pttt -58.57 -28.11 65.23 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.701 0.4 . . . . 0.0 111.569 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -79.08 -25.73 43.06 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.81 0.844 . . . . 0.0 110.957 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.1 t -93.81 1.46 56.44 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.614 0.366 . . . . 0.0 111.926 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -109.72 151.46 26.89 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.895 -0.503 . . . . 0.0 110.038 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.8 p -123.51 -171.73 2.37 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.688 0.795 . . . . 0.0 109.996 -175.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.7 -20.3 65.94 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.442 0.697 . . . . 0.0 112.478 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 m -75.89 -21.74 56.83 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.193 0.597 . . . . 0.0 111.859 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -71.55 137.62 48.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.669 0.787 . . . . 0.0 111.422 -175.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.88 160.72 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 C-N-CA 124.573 1.149 . . . . 0.0 109.224 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.6 mt -117.1 -68.51 0.91 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.03 109.31 1.24 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.805 174.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.25 -34.27 5.81 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.273 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -77.27 -57.65 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 12.9 mm -81.73 116.46 63.3 Favored Pre-proline 0 CA--C 1.543 0.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -175.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -77.18 -8.08 17.4 Favored 'Trans proline' 0 C--N 1.369 1.633 0 C-N-CA 122.459 2.106 . . . . 0.0 112.02 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.406 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 6.0 mm-40 -96.48 -6.82 36.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.983 0.913 . . . . 0.0 110.659 -178.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.1 tp -81.72 80.76 7.97 Favored 'General case' 0 C--N 1.349 0.584 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -82.01 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.476 1.511 . . . . 0.0 110.607 -179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.565 ' O ' HG21 ' A' ' 42' ' ' VAL . 48.1 t -43.95 -66.73 0.35 Allowed 'General case' 0 CA--C 1.566 1.577 0 C-N-CA 126.163 1.785 . . . . 0.0 112.469 170.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 95.0 mmm -70.56 -15.26 62.75 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.652 -0.655 . . . . 0.0 111.748 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.22 -25.34 51.56 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.319 174.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.565 HG21 ' O ' ' A' ' 39' ' ' SER . 4.7 m -69.61 -37.99 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.12 -42.33 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.648 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.49 ' ND2' HG12 ' A' ' 14' ' ' VAL . 59.6 t30 -68.26 -37.75 81.07 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.553 -176.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.2 m -72.53 -35.71 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.69 177.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.494 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 93.1 mt -59.97 -48.51 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 33.0 m -56.86 -45.06 82.72 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 124.373 1.046 . . . . 0.0 110.732 177.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.26 -41.65 98.63 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.689 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.549 HD21 HG23 ' A' ' 10' ' ' ILE . 3.4 mm? -56.58 -46.68 80.67 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.197 0.599 . . . . 0.0 109.9 176.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.2 mm-40 -51.66 -50.52 60.2 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.266 1.026 . . . . 0.0 110.386 176.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.2 mm-40 -59.81 -63.96 1.11 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.76 -176.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -65.05 -46.02 82.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.651 -169.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -87.67 -7.66 57.13 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.1 t70 65.19 36.41 7.17 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.93 0.892 . . . . 0.0 111.042 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.19 -175.53 3.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.413 0.685 . . . . 0.0 110.118 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -123.14 135.64 54.44 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 37.2 t -84.75 125.19 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 170.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' ILE . 30.2 t70 -75.13 151.33 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.148 0.579 . . . . 0.0 111.083 -174.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -53.45 -41.76 66.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.406 1.082 . . . . 0.0 113.137 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -67.58 -17.96 64.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.836 0.854 . . . . 0.0 111.962 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -115.44 8.01 15.16 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.524 0.729 . . . . 0.0 111.436 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' ASP . 28.9 mt -98.41 105.44 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 77.5 p -146.27 173.23 12.43 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.645 0.778 . . . . 0.0 109.532 171.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.76 71.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 169.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.33 -21.1 66.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.147 0.579 . . . . 0.0 111.469 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.2 m -72.52 -40.31 66.89 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.259 0.624 . . . . 0.0 110.071 175.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.617 ' HA ' HD22 ' A' ' 73' ' ' LEU . 62.3 m-85 -97.43 18.32 15.55 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.634 0.774 . . . . 0.0 113.037 -174.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HG3' HG23 ' A' ' 69' ' ' THR . 9.5 pt-20 -63.58 -46.34 86.29 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.681 0.392 . . . . 0.0 111.629 178.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.52 HG23 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -145.51 155.05 42.85 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 123.354 0.662 . . . . 0.0 110.531 -177.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.56 -32.73 67.41 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.724 0.81 . . . . 0.0 111.296 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.15 -41.68 98.25 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.953 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.2 m -60.4 -52.92 63.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.915 0.486 . . . . 0.0 110.33 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.617 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -61.34 -39.73 91.64 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 123.568 0.542 . . . . 0.0 110.938 -178.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.554 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.08 -49.68 75.1 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.424 1.077 . . . . 0.0 109.988 178.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.14 -39.46 89.86 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.708 0.63 . . . . 0.0 111.702 -177.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.502 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 34.9 m-85 -59.79 -54.75 42.64 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.7 m -67.1 -26.16 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 122.829 0.451 . . . . 0.0 111.787 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.61 ' HG3' ' SD ' ' A' ' 1' ' ' MET . 76.4 mm-40 -57.23 -51.9 67.49 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 170.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 47.9 m170 -63.01 -49.38 74.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.134 -175.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.1 mmmt -60.54 -55.15 36.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.784 0.834 . . . . 0.0 112.04 -172.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.59 -14.32 61.59 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.871 -176.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 122.963 0.505 . . . . 0.0 111.442 173.997 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.495 ' HG2' ' HB1' ' A' ' 74' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -96.88 -44.28 7.11 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 118.446 0.566 . . . . 0.0 112.067 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.416 ' O ' HG22 ' A' ' 7' ' ' VAL . 82.6 m-70 -75.11 -12.86 60.4 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.939 -169.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.29 -31.2 63.43 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 118.216 0.462 . . . . 0.0 111.4 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -66.53 -52.88 41.0 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 125.006 1.322 . . . . 0.0 110.628 -178.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.489 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.1 -32.25 71.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.506 -178.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.416 HG22 ' O ' ' A' ' 3' ' ' HIS . 86.5 t -68.43 -48.67 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.742 0.417 . . . . 0.0 110.354 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.426 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 40.7 ptt180 -67.55 -30.11 69.67 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.453 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 37.4 t30 -62.24 -46.64 87.92 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.531 0.733 . . . . 0.0 109.914 176.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 6' ' ' ALA . 69.8 mt -61.71 -56.38 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 O-C-N 124.366 1.041 . . . . 0.0 111.672 179.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.531 HD21 HD11 ' A' ' 30' ' ' LEU . 9.7 mp -64.83 -34.03 77.4 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.922 0.139 . . . . 0.0 111.351 -176.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.51 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.79 -18.22 79.1 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 119.813 -0.437 . . . . 0.0 113.309 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.28 -53.04 7.34 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.742 0.417 . . . . 0.0 110.289 174.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.73 -58.57 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.325 1.05 . . . . 0.0 109.829 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.516 HD11 HD23 ' A' ' 37' ' ' LEU . 64.0 mt -77.15 -8.21 57.14 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.135 -175.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.57 62.94 1.05 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.475 1.11 . . . . 0.0 110.717 172.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.566 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 4.1 mm? -85.27 -27.96 25.64 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.587 170.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 69.1 -107.5 2.12 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.873 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.33 -26.22 51.88 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.632 0.773 . . . . 0.0 111.147 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.566 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.68 -32.93 74.09 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.879 0.872 . . . . 0.0 110.068 -172.172 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.51 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.5 pttt -64.37 -34.83 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.95 -177.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -89.49 -21.19 23.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.218 0.207 . . . . 0.0 110.499 -173.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.417 HG23 ' HA ' ' A' ' 20' ' ' ARG . 6.8 t -91.96 7.14 43.51 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.027 0.531 . . . . 0.0 110.94 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -109.0 156.15 20.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.893 0.477 . . . . 0.0 109.77 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 p -111.88 -178.26 3.39 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.248 1.019 . . . . 0.0 110.709 -175.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.49 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -66.53 -27.66 67.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.363 0.665 . . . . 0.0 111.315 177.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.4 p -78.32 -4.04 46.06 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.65 0.78 . . . . 0.0 112.419 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.9 t -80.6 141.01 35.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.137 0.575 . . . . 0.0 110.198 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.3 t -80.65 151.63 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.437 1.095 . . . . 0.0 109.026 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.531 HD11 HD21 ' A' ' 11' ' ' LEU . 82.5 mt -118.58 -69.74 0.83 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.131 0.572 . . . . 0.0 109.929 177.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.8 122.46 18.17 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 175.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.48 -34.78 5.04 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.006 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -86.32 -67.49 0.81 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.195 0.598 . . . . 0.0 111.014 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.2 mm -64.47 119.66 58.69 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 123.278 0.631 . . . . 0.0 109.981 -172.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -72.9 -6.38 18.91 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.719 2.279 . . . . 0.0 112.699 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -96.48 -14.6 22.24 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.756 0.822 . . . . 0.0 110.872 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.516 HD23 HD11 ' A' ' 15' ' ' LEU . 3.1 tm? -84.93 85.29 7.49 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -178.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.43 ' H ' ' HB2' ' A' ' 41' ' ' ALA . 8.3 t70 -108.79 -173.19 2.21 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.377 1.071 . . . . 0.0 108.846 177.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.528 ' O ' HG23 ' A' ' 42' ' ' VAL . 39.8 t -49.37 -70.93 0.07 Allowed 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 125.711 1.604 . . . . 0.0 114.5 -173.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -62.75 -25.58 68.27 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 121.708 -0.62 . . . . 0.0 111.358 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.43 ' HB2' ' H ' ' A' ' 38' ' ' ASP . . . -69.43 -29.53 67.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.312 0.645 . . . . 0.0 112.355 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 39' ' ' SER . 3.0 m -65.98 -40.5 87.53 Favored 'Isoleucine or valine' 0 C--N 1.37 1.478 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 172.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.9 t -67.15 -40.43 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.463 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -65.12 -43.12 92.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.272 . . . . 0.0 112.037 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.0 m -72.52 -33.13 44.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.089 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.512 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -60.92 -48.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 173.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.459 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 68.1 m -55.77 -44.04 77.29 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 124.301 1.001 . . . . 0.0 110.528 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.57 86.54 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.212 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.426 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -54.21 -50.63 66.66 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 172.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -54.89 -46.04 74.76 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.17 177.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 47' ' ' THR . 30.0 mm-40 -61.66 -60.58 3.46 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.061 0.944 . . . . 0.0 112.093 -177.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -66.91 -46.29 75.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -172.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.498 ' HB3' HD13 ' A' ' 81' ' ' LEU . 93.4 m-85 -84.1 -19.64 33.92 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-O 119.082 -0.485 . . . . 0.0 112.078 -177.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.56 47.74 1.59 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.248 1.019 . . . . 0.0 111.633 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.436 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.5 OUTLIER -137.6 -174.27 3.72 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.906 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.8 t -134.84 117.08 15.52 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 122.767 0.427 . . . . 0.0 110.962 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.431 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 11.7 t -68.96 132.79 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 33.5 t70 -76.26 147.08 38.53 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.592 0.357 . . . . 0.0 110.392 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -57.39 -42.34 81.98 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.199 0.599 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.08 -14.96 62.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.209 0.604 . . . . 0.0 112.289 -174.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.8 pt-20 -103.31 -11.34 17.99 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.864 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 54.5 mt -85.92 116.17 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.234 0.614 . . . . 0.0 110.392 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -145.85 -178.96 6.38 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.879 1.272 . . . . 0.0 108.849 171.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 -34.37 78.22 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 171.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -71.94 -11.17 60.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.671 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.6 m -76.29 -36.67 58.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.226 0.61 . . . . 0.0 110.058 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.51 ' HA ' HD22 ' A' ' 73' ' ' LEU . 40.9 m-85 -99.79 14.76 29.18 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.948 0.499 . . . . 0.0 112.082 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -60.89 -45.62 93.86 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.432 0.293 . . . . 0.0 110.659 -178.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.0 p -138.04 163.59 31.22 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.784 0.833 . . . . 0.0 110.168 176.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 55.0 tp -59.29 -37.18 77.06 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.029 176.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.1 -34.3 89.57 Favored Glycine 0 C--N 1.34 0.753 0 CA-C-N 114.684 -1.144 . . . . 0.0 112.346 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -60.31 -54.89 40.24 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 122.859 0.464 . . . . 0.0 109.885 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.51 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.96 -44.3 91.46 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 124.025 0.828 . . . . 0.0 110.313 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.592 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -54.5 -46.87 73.55 Favored 'General case' 0 C--O 1.217 -0.636 0 O-C-N 124.64 1.212 . . . . 0.0 110.969 -178.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.475 HD21 ' SD ' ' A' ' 1' ' ' MET . 3.6 mm? -65.87 -47.64 74.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.813 0.845 . . . . 0.0 111.346 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.503 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 52.6 m-85 -56.39 -53.03 62.14 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.7 m -70.68 -23.81 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.653 0.781 . . . . 0.0 112.205 -177.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -54.19 -52.88 59.8 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -70.64 -29.6 66.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.989 -1.46 . . . . 0.0 112.114 -173.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -72.04 -58.09 3.73 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.478 0.711 . . . . 0.0 110.847 178.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.498 HD13 ' HB3' ' A' ' 53' ' ' PHE . 3.9 mm? -68.2 -11.24 58.95 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.556 -176.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 N--CA 1.484 1.234 0 C-N-CA 123.131 0.572 . . . . 0.0 111.113 167.378 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.949 0.404 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -94.1 -55.03 3.35 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.888 0.851 . . . . 0.0 109.343 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -78.21 -9.2 59.1 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.593 -163.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -53.2 -32.48 48.25 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.551 0.74 . . . . 0.0 111.887 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -66.12 -50.64 63.32 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 124.576 1.151 . . . . 0.0 111.074 -177.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.71 -29.58 63.5 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.503 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 90.1 t -67.82 -48.28 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.845 0.458 . . . . 0.0 109.995 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -70.3 -28.26 65.04 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.538 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 44.0 t30 -63.13 -46.52 86.88 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.326 0.651 . . . . 0.0 109.831 173.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.57 -53.86 42.45 Favored 'Isoleucine or valine' 0 C--N 1.351 0.643 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.258 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.54 -34.8 79.09 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.195 0.31 . . . . 0.0 110.551 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.56 -20.53 71.96 Favored Glycine 0 C--N 1.343 0.963 0 CA-C-O 119.947 -0.363 . . . . 0.0 113.398 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -86.06 -56.9 3.24 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.634 0.774 . . . . 0.0 111.059 173.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.07 -54.0 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.602 1.161 . . . . 0.0 111.141 -173.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.52 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 64.6 mt -80.61 -14.53 58.1 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 64.22 62.0 0.87 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.835 1.254 . . . . 0.0 110.863 172.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.632 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 1.7 mm? -86.26 -26.09 25.19 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.3 172.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.43 -83.94 0.14 Allowed Glycine 0 C--N 1.348 1.217 0 O-C-N 124.048 0.843 . . . . 0.0 113.256 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.18 -25.67 14.19 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.641 0.776 . . . . 0.0 111.025 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.632 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.26 -28.03 68.4 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.209 0.603 . . . . 0.0 111.078 -175.388 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.3 pttt -58.76 -34.0 70.91 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.228 0.611 . . . . 0.0 111.369 173.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -90.81 -10.61 42.16 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.98 0.912 . . . . 0.0 111.803 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.5 t -97.51 -7.06 32.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.701 0.401 . . . . 0.0 111.52 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -103.07 147.57 26.8 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 49.8 p -113.82 -172.56 2.11 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.673 0.789 . . . . 0.0 110.653 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.88 -53.46 57.04 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 123.313 0.645 . . . . 0.0 111.658 -178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -69.54 -5.46 24.41 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -77.95 150.42 34.0 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-O 121.014 0.435 . . . . 0.0 110.365 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.2 t -83.49 151.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.928 -174.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.1 mt -114.82 -62.53 1.59 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.024 0.53 . . . . 0.0 109.614 173.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 tt -65.61 110.48 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.77 -40.71 2.37 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 116.366 -0.379 . . . . 0.0 112.522 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -77.63 -40.71 40.96 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.13 0.49 . . . . 0.0 110.54 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.513 HG23 HD13 ' A' ' 17' ' ' LEU . 39.8 mm -84.51 121.92 75.01 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 175.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.05 -17.42 31.77 Favored 'Trans proline' 0 C--N 1.371 1.744 0 C-N-CA 122.648 2.232 . . . . 0.0 112.155 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.52 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 19.5 mm-40 -93.92 -12.53 28.63 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.987 0.915 . . . . 0.0 111.389 -172.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.425 HD21 HD13 ' A' ' 15' ' ' LEU . 2.9 tm? -76.92 94.89 4.0 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.44 ' H ' ' HB2' ' A' ' 41' ' ' ALA . 16.6 t70 -132.45 -168.82 2.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.184 0.994 . . . . 0.0 110.005 -171.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.491 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -56.07 -72.92 0.07 Allowed 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 125.988 1.715 . . . . 0.0 114.599 -170.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.402 ' SD ' H311 ' A' ' 84' ' ' PNS . 25.2 mmt -70.45 -21.11 62.83 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 121.165 -0.959 . . . . 0.0 110.845 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.44 ' HB2' ' H ' ' A' ' 38' ' ' ASP . . . -68.37 -34.62 76.39 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.342 177.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.491 HG22 ' O ' ' A' ' 39' ' ' SER . 34.3 m -70.58 -38.06 72.07 Favored 'Isoleucine or valine' 0 C--N 1.372 1.556 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -59.46 -43.34 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.417 0.627 . . . . 0.0 110.161 176.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.26 -45.94 85.91 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.053 -1.43 . . . . 0.0 111.482 -175.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.433 HG21 ' HA ' ' A' ' 42' ' ' VAL . 28.2 m -68.74 -33.62 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-O 118.894 -0.574 . . . . 0.0 111.533 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.512 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.5 mt -60.42 -52.25 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.513 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 40.1 m -54.18 -46.23 72.31 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 124.646 1.217 . . . . 0.0 110.224 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.403 ' O ' ' HD2' ' A' ' 52' ' ' TYR . . . -59.89 -42.77 94.55 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.073 0.949 . . . . 0.0 112.251 178.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.84 -46.82 78.07 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.348 0.659 . . . . 0.0 110.213 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.1 mm-40 -56.82 -45.89 82.01 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 124.128 0.892 . . . . 0.0 110.529 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 47' ' ' THR . 67.2 mm-40 -59.09 -64.11 1.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 O-C-N 124.245 0.966 . . . . 0.0 111.281 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.403 ' HD2' ' O ' ' A' ' 48' ' ' ALA . 83.1 m-85 -66.96 -37.46 84.3 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.653 0.781 . . . . 0.0 112.719 -169.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -91.65 -6.05 52.82 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 119.35 -0.357 . . . . 0.0 111.797 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 63.11 34.63 13.53 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.298 1.039 . . . . 0.0 111.841 169.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.14 -171.98 2.94 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.407 -175.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.8 t -135.66 126.21 26.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.42 0.288 . . . . 0.0 110.481 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.3 t -77.53 132.93 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.438 ' O ' HG13 ' A' ' 62' ' ' ILE . 20.5 t70 -71.81 143.72 49.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.04 0.536 . . . . 0.0 110.52 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.7 -41.64 82.12 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.888 0.875 . . . . 0.0 112.1 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -75.56 1.4 14.42 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.918 0.887 . . . . 0.0 112.516 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.92 -11.09 8.99 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.696 0.398 . . . . 0.0 111.43 172.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 58' ' ' ASP . 50.9 mt -82.37 113.86 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.7 t -136.09 175.15 9.87 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.869 0.868 . . . . 0.0 109.216 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.69 76.5 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 170.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -64.89 -21.36 66.8 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.59 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.426 HG23 HD11 ' A' ' 73' ' ' LEU . 58.3 m -68.11 -36.74 80.24 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.848 0.459 . . . . 0.0 110.356 177.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.546 ' HA ' HD23 ' A' ' 73' ' ' LEU . 87.2 m-85 -95.67 16.63 16.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.978 0.511 . . . . 0.0 112.305 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -61.88 -46.67 88.38 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.227 0.33 . . . . 0.0 110.88 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.0 p -139.48 163.44 32.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.958 0.903 . . . . 0.0 110.407 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.4 tp -64.93 -31.01 72.04 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.581 0.752 . . . . 0.0 110.909 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.67 -29.54 69.49 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.716 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.0 m -64.1 -52.94 56.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.996 0.519 . . . . 0.0 110.3 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.546 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -59.3 -45.36 91.49 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 123.316 0.385 . . . . 0.0 110.811 177.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.37 87.06 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.195 0.934 . . . . 0.0 111.094 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -61.05 -53.46 56.92 Favored 'General case' 0 C--N 1.352 0.674 0 O-C-N 123.744 0.652 . . . . 0.0 109.809 178.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.475 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.2 m-85 -55.29 -52.65 62.75 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.152 0.908 . . . . 0.0 111.586 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.4 m -65.27 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 123.355 0.409 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.34 -18.65 59.94 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.607 0.363 . . . . 0.0 111.731 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -80.29 -37.86 31.91 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.314 0.506 . . . . 0.0 109.662 171.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.6 mmmt -62.57 -58.32 7.99 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.095 0.958 . . . . 0.0 111.765 -176.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.02 -14.91 62.51 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.105 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.9 m -91.42 -31.2 16.11 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.932 0.493 . . . . 0.0 111.624 176.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 123.683 0.793 . . . . 0.0 109.119 -177.621 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.432 H421 HD12 ' A' ' 46' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.106 0.479 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -96.09 -55.04 3.09 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -70.85 -10.17 59.04 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.226 -1.352 . . . . 0.0 114.125 -165.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.0 -34.64 43.63 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.64 -34.87 67.6 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 120.825 0.345 . . . . 0.0 110.487 -175.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.71 -30.6 56.74 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.63 0.772 . . . . 0.0 110.71 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 95.5 t -67.02 -47.93 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -72.64 -26.0 61.49 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 122.662 0.385 . . . . 0.0 110.717 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.454 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.7 t30 -62.25 -47.55 83.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.158 0.583 . . . . 0.0 109.577 171.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.86 -47.44 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.979 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.63 -38.83 89.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.237 0.615 . . . . 0.0 110.534 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.55 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.84 -19.69 78.3 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.815 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -84.28 -52.06 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.404 0.682 . . . . 0.0 110.975 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.5 t -69.72 -49.28 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.906 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 41' ' ' ALA . 1.7 mm? -90.89 -6.51 54.07 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.144 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 64.61 65.62 0.63 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.126 0.97 . . . . 0.0 111.298 174.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.55 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 8.8 mp -85.75 -38.81 17.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.62 0.768 . . . . 0.0 110.799 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.68 -90.38 0.56 Allowed Glycine 0 C--N 1.35 1.322 0 O-C-N 123.31 0.381 . . . . 0.0 112.652 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.31 -19.92 16.81 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.903 0.881 . . . . 0.0 110.454 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.448 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -64.87 -31.95 73.43 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.459 0.704 . . . . 0.0 109.801 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.8 pttt -68.97 -32.88 72.78 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.793 0.437 . . . . 0.0 110.765 174.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -79.84 -29.75 40.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.171 0.589 . . . . 0.0 110.659 -173.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 t -81.63 -16.28 51.95 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.943 -177.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 pp -95.54 155.92 16.54 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.72 0.295 . . . . 0.0 110.867 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.5 p -117.65 -172.35 2.22 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.263 1.025 . . . . 0.0 111.086 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.21 75.39 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.345 0.658 . . . . 0.0 111.779 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -80.19 3.84 19.41 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.546 0.738 . . . . 0.0 112.266 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.2 t -75.38 136.65 40.77 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.691 0.396 . . . . 0.0 110.408 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.03 147.57 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.7 mt -108.26 -67.78 0.95 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 122.243 -0.286 . . . . 0.0 110.365 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.4 mt -56.73 116.33 3.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.812 0.445 . . . . 0.0 111.07 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.66 -23.43 19.64 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-N 115.331 -0.849 . . . . 0.0 113.807 176.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -77.2 -55.85 5.07 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 170.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 24.8 mm -76.52 118.08 69.04 Favored Pre-proline 0 C--O 1.241 0.634 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 176.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.48 -4.38 14.96 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.541 2.161 . . . . 0.0 112.517 -173.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 46.7 mm-40 -105.98 -15.85 14.79 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.972 0.909 . . . . 0.0 111.157 -175.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.0 tp -80.36 87.98 5.59 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 110.112 -175.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -99.62 -171.02 1.98 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.934 0.893 . . . . 0.0 111.201 174.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.53 ' O ' HG21 ' A' ' 42' ' ' VAL . 78.0 p -66.12 -53.05 42.69 Favored 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.454 1.101 . . . . 0.0 112.096 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -59.64 -30.52 68.79 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.709 0.766 . . . . 0.0 110.578 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.574 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -69.14 -26.91 65.12 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.634 174.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.53 HG21 ' O ' ' A' ' 39' ' ' SER . 2.2 m -65.8 -38.34 81.99 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.539 HG22 H381 ' A' ' 84' ' ' PNS . 7.5 t -62.61 -47.05 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 CA-C-O 121.259 0.552 . . . . 0.0 110.041 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.67 -51.47 68.65 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.797 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.6 m -68.26 -35.91 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.401 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.546 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -62.31 -45.77 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.49 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 54.3 m -57.87 -46.14 85.3 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 124.064 0.853 . . . . 0.0 110.595 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.0 -37.08 86.12 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -57.89 -50.67 72.54 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.236 0.614 . . . . 0.0 109.661 172.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.8 mm-40 -50.55 -51.21 50.02 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.61 1.164 . . . . 0.0 110.78 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 47' ' ' THR . 12.5 mm-40 -65.58 -53.49 41.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.454 -174.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -65.66 -46.24 79.91 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.486 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 2.9 m-85 -91.52 -13.8 31.48 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.628 -175.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 65.65 39.96 4.66 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.448 1.099 . . . . 0.0 111.418 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -131.94 179.36 6.13 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.686 0.794 . . . . 0.0 110.085 -177.108 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.9 t -130.53 112.22 12.99 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.988 0.18 . . . . 0.0 111.25 175.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.485 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.3 t -70.36 114.08 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.492 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.5 t70 -69.03 147.24 51.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 -168.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.041 0.536 . . . . 0.0 112.408 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.92 -7.97 39.9 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.788 0.835 . . . . 0.0 113.233 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -115.02 -11.66 12.09 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.987 0.515 . . . . 0.0 111.825 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 58' ' ' ASP . 51.9 mt -88.51 125.51 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 120.737 0.303 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.7 t -143.49 176.95 8.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.784 1.234 . . . . 0.0 108.948 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.99 -32.16 73.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.692 0.758 . . . . 0.0 109.38 167.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -69.2 -16.31 63.58 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 114.598 -1.183 . . . . 0.0 111.485 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 88.5 m -74.85 -39.2 61.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.405 0.682 . . . . 0.0 109.699 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.517 ' HA ' HD22 ' A' ' 73' ' ' LEU . 96.4 m-85 -93.96 17.29 12.52 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.848 0.859 . . . . 0.0 112.751 -176.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.08 -46.58 83.66 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 122.135 0.174 . . . . 0.0 110.688 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.1 p -138.35 161.11 37.77 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.44 0.696 . . . . 0.0 111.301 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.6 tp -57.75 -42.66 84.4 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.0 0.92 . . . . 0.0 110.816 175.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.62 -31.08 78.67 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.497 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -63.09 -53.59 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.968 0.507 . . . . 0.0 110.401 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.517 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.9 mm? -57.57 -42.58 83.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.4 0.438 . . . . 0.0 110.119 177.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.552 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.45 -42.45 98.79 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.43 -177.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -48.29 78.26 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.098 0.559 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.525 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 37.2 m-85 -53.59 -54.6 35.27 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 123.733 0.646 . . . . 0.0 110.26 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.51 -25.85 34.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.109 0.563 . . . . 0.0 112.372 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 62.8 mm-40 -56.97 -51.45 69.17 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 169.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -67.3 -30.36 70.19 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.835 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.7 mmmt -64.63 -56.88 11.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.613 0.765 . . . . 0.0 112.226 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.2 -13.37 62.37 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.333 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.6 m -67.2 -38.68 85.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.859 0.463 . . . . 0.0 110.638 169.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 58.1 m80 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 123.271 0.628 . . . . 0.0 110.196 179.081 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.539 H381 HG22 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.861 0.362 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.23 -37.55 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.267 1.027 . . . . 0.0 110.467 177.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -70.96 -22.01 62.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -168.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -51.9 -31.74 29.65 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.032 0.933 . . . . 0.0 113.138 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -75.12 -40.31 59.94 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 122.87 0.468 . . . . 0.0 111.25 -175.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.65 -28.61 64.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.992 0.517 . . . . 0.0 111.03 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.468 HG22 HD11 ' A' ' 49' ' ' LEU . 90.0 t -66.9 -49.24 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 41.8 ptt180 -71.03 -25.12 62.52 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.2 t30 -61.85 -49.32 76.76 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 123.335 0.654 . . . . 0.0 109.318 173.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.0 mt -60.54 -51.44 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.633 177.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.9 -34.24 77.69 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.224 0.21 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.567 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -72.4 -21.46 79.4 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-O 120.196 -0.224 . . . . 0.0 113.262 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.02 -57.14 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.4 0.68 . . . . 0.0 110.176 176.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 97.1 t -71.11 -47.38 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.741 1.216 . . . . 0.0 110.534 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.404 HD13 HD13 ' A' ' 37' ' ' LEU . 44.1 mt -83.46 -6.5 59.47 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.553 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 63.41 59.91 1.19 Allowed 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.58 1.152 . . . . 0.0 110.916 172.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.567 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.7 mp -89.65 -29.61 18.69 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.45 173.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.0 -89.88 0.21 Allowed Glycine 0 C--N 1.351 1.406 0 O-C-N 123.978 0.799 . . . . 0.0 112.31 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -101.17 -18.94 15.95 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.928 0.891 . . . . 0.0 110.857 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.86 -26.93 69.01 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.233 0.613 . . . . 0.0 111.095 -177.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.1 pttt -62.87 -34.91 78.36 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 123.246 0.618 . . . . 0.0 111.313 173.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -69.7 -29.1 66.43 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.386 1.074 . . . . 0.0 110.995 -176.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -93.26 -6.57 47.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -174.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -99.34 153.53 18.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 176.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.2 p -112.9 -176.07 2.81 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 111.184 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.95 -50.24 74.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.796 0.838 . . . . 0.0 110.668 173.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.1 m -71.54 -12.48 61.39 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.205 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -69.75 140.93 53.5 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 123.311 0.644 . . . . 0.0 110.168 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 63.6 t -79.37 152.21 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.364 1.066 . . . . 0.0 109.848 -176.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.28 -65.74 1.16 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.437 0.695 . . . . 0.0 109.862 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.1 mt -60.56 111.71 1.7 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.05 0.452 . . . . 0.0 110.703 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 103.03 -30.53 10.23 Favored Glycine 0 C--N 1.333 0.416 0 CA-C-N 115.061 -0.972 . . . . 0.0 112.79 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -79.54 -53.61 6.7 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.005 0.431 . . . . 0.0 110.058 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 26.8 mm -87.29 120.82 71.45 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.72 -14.83 33.36 Favored 'Trans proline' 0 C--N 1.372 1.765 0 C-N-CA 122.39 2.06 . . . . 0.0 112.22 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -85.83 -18.23 33.47 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 -174.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.404 HD13 HD13 ' A' ' 15' ' ' LEU . 40.2 tp -83.28 80.18 9.16 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 122.036 0.922 . . . . 0.0 110.272 -175.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -93.8 177.31 6.04 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.976 1.71 . . . . 0.0 109.681 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.714 ' HB3' H281 ' A' ' 84' ' ' PNS . 3.6 m -44.34 -64.11 0.75 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.827 1.251 . . . . 0.0 113.35 170.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.8 mmt -65.92 -26.83 67.78 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 121.512 -0.742 . . . . 0.0 111.236 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.18 -38.32 87.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.286 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 39' ' ' SER . 15.1 m -67.07 -35.06 73.52 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 176.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 t -62.17 -48.49 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 121.688 0.756 . . . . 0.0 110.177 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -59.62 -46.36 89.2 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 113.656 -1.611 . . . . 0.0 112.475 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.7 m -73.67 -30.86 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.127 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.426 HD11 HD12 ' A' ' 62' ' ' ILE . 96.4 mt -63.41 -48.77 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.7 m -55.84 -47.01 77.99 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.421 1.076 . . . . 0.0 110.153 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 -40.67 97.3 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.864 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.468 HD11 HG22 ' A' ' 7' ' ' VAL . 2.1 mm? -56.16 -49.91 72.63 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.284 0.564 . . . . 0.0 109.858 175.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -63.53 -38.67 92.0 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.594 -1.185 . . . . 0.0 112.249 -178.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -66.77 -54.57 21.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.406 0.682 . . . . 0.0 111.072 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -57.63 -57.6 12.01 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.788 0.835 . . . . 0.0 111.325 -177.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -82.55 -15.01 53.9 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.204 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 64.0 58.84 1.15 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.854 0.862 . . . . 0.0 111.427 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.438 ' CE2' HG23 ' A' ' 57' ' ' VAL . 8.9 p90 -142.95 -177.69 5.46 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.311 173.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.3 m -131.0 121.19 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.882 0.473 . . . . 0.0 110.311 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.438 HG23 ' CE2' ' A' ' 55' ' ' PHE . 2.1 t -77.69 127.31 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 29.4 t70 -89.83 153.75 20.42 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 122.799 0.44 . . . . 0.0 110.651 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -58.41 -34.29 70.6 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.043 0.937 . . . . 0.0 113.223 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -59.75 -33.76 72.08 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.837 0.855 . . . . 0.0 112.156 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.0 pt-20 -97.99 -15.86 19.91 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.462 0.705 . . . . 0.0 110.822 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.426 HD12 HD11 ' A' ' 46' ' ' ILE . 38.4 mt -83.84 119.7 33.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 123.09 0.556 . . . . 0.0 111.061 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 82.9 p -155.29 -172.0 4.01 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.055 0.942 . . . . 0.0 109.378 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.48 -29.72 69.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.058 0.456 . . . . 0.0 110.38 171.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -67.94 -13.44 62.16 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.832 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.1 m -79.26 -41.47 28.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 0.0 110.105 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.455 ' HA ' HD22 ' A' ' 73' ' ' LEU . 78.6 m-85 -99.31 15.53 25.91 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.94 -49.6 76.8 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 123.055 0.222 . . . . 0.0 110.904 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 74.5 p -138.14 164.29 29.53 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.534 0.734 . . . . 0.0 110.515 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 tp -62.82 -34.5 77.44 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.205 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.02 -31.91 79.29 Favored Glycine 0 C--N 1.341 0.85 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.399 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -62.57 -53.01 61.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.164 0.586 . . . . 0.0 110.103 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.455 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.48 -41.91 81.63 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 123.357 0.41 . . . . 0.0 110.612 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.55 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.22 -44.95 92.29 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 124.048 0.843 . . . . 0.0 110.891 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.84 -54.95 41.08 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.195 0.998 . . . . 0.0 110.118 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 66.2 m-85 -53.83 -55.87 22.7 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.013 0.82 . . . . 0.0 110.753 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 19.6 m -66.48 -25.98 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 79.3 mm-40 -59.17 -52.67 64.7 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -60.8 -38.99 87.23 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.102 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -67.93 -52.43 36.23 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.598 0.759 . . . . 0.0 111.606 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.37 -17.96 62.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.989 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -78.59 -34.97 46.4 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.819 0.448 . . . . 0.0 111.059 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m80 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 123.38 0.672 . . . . 0.0 110.039 -175.571 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.714 H281 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.99 -21.52 15.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.414 0.686 . . . . 0.0 111.402 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -90.72 -14.84 31.36 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 118.209 -0.901 . . . . 0.0 113.086 -174.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.52 -28.22 43.77 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 118.785 0.721 . . . . 0.0 112.203 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 39.3 tt0 -67.97 -46.84 70.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.764 0.825 . . . . 0.0 110.601 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.61 70.43 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.426 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 89.2 t -66.26 -48.38 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 122.864 0.465 . . . . 0.0 109.788 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 5' ' ' GLU . 37.1 ptt180 -69.08 -26.76 65.1 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 123.533 0.521 . . . . 0.0 110.144 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -61.42 -51.39 68.92 Favored 'General case' 0 C--N 1.351 0.644 0 C-N-CA 123.532 0.733 . . . . 0.0 109.506 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.5 mt -62.73 -49.12 84.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.105 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.84 -45.9 87.44 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.06 0.544 . . . . 0.0 111.047 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.469 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -69.93 -18.42 74.4 Favored Glycine 0 C--N 1.337 0.605 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.442 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -81.14 -53.22 6.57 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 117.293 0.546 . . . . 0.0 110.228 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.65 -49.8 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 124.066 0.946 . . . . 0.0 111.141 -173.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.493 HD12 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -82.76 -7.4 59.66 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.892 0.477 . . . . 0.0 111.159 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 t30 62.23 64.03 1.01 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.668 1.187 . . . . 0.0 111.644 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 9.6 mp -88.66 -31.43 18.52 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.91 170.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.93 -99.62 0.5 Allowed Glycine 0 C--N 1.352 1.431 0 O-C-N 123.552 0.533 . . . . 0.0 113.617 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.15 -23.18 35.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.056 0.943 . . . . 0.0 110.689 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.554 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.56 -30.21 69.78 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 122.944 0.498 . . . . 0.0 111.234 -175.384 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.469 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.1 pttt -65.15 -26.21 68.08 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 120.689 0.281 . . . . 0.0 111.341 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -79.5 -33.74 41.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.265 0.626 . . . . 0.0 110.691 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 t -83.2 -8.59 59.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -173.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.4 pp -96.23 166.78 11.57 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 120.969 0.414 . . . . 0.0 110.524 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 73.3 p -115.1 -178.91 3.48 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.113 0.965 . . . . 0.0 110.335 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.89 -14.94 57.46 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.139 0.576 . . . . 0.0 112.209 174.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.4 t -90.9 8.25 35.99 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.045 0.538 . . . . 0.0 111.587 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 94.1 p -78.87 121.2 24.54 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.62 0.368 . . . . 0.0 110.15 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.02 145.71 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.449 ' HA ' HG12 ' A' ' 34' ' ' ILE . 55.2 mt -101.69 -70.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.6 mt -57.94 114.95 2.56 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 122.954 0.501 . . . . 0.0 111.393 178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.05 -38.1 3.22 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.121 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -75.92 -51.99 11.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.906 0.482 . . . . 0.0 109.913 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 30' ' ' LEU . 19.6 mm -79.08 112.23 26.24 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 175.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.34 2.27 8.62 Favored 'Trans proline' 0 C--N 1.369 1.652 0 C-N-CA 122.764 2.309 . . . . 0.0 112.113 -177.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 23.4 mm-40 -97.12 -19.41 18.69 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 123.802 0.841 . . . . 0.0 109.688 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.34 96.86 6.79 Favored 'General case' 0 C--N 1.352 0.697 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -90.77 173.87 7.78 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.801 1.24 . . . . 0.0 109.615 172.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.598 ' O ' HG23 ' A' ' 42' ' ' VAL . 86.6 p -59.21 -49.13 79.01 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.508 0.723 . . . . 0.0 111.081 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.3 mmt -60.51 -31.19 70.26 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.9 -0.5 . . . . 0.0 110.724 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.493 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -69.57 -29.01 66.48 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.346 176.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 39' ' ' SER . 2.3 m -63.8 -37.2 79.09 Favored 'Isoleucine or valine' 0 C--N 1.372 1.584 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.484 HG23 H313 ' A' ' 84' ' ' PNS . 9.8 t -66.92 -47.46 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.174 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.59 -42.78 88.84 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.031 -1.441 . . . . 0.0 112.173 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -75.7 -31.01 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.654 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.8 mt -59.79 -54.43 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 172.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 37.7 m -51.37 -49.2 61.96 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 124.673 1.233 . . . . 0.0 110.868 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.78 -43.78 98.18 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.014 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -55.59 -47.97 75.61 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.144 0.578 . . . . 0.0 110.333 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -59.4 -43.83 92.91 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.983 0.913 . . . . 0.0 111.241 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 47' ' ' THR . 33.2 mm-40 -65.12 -59.12 4.46 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.597 0.759 . . . . 0.0 111.097 -177.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -67.34 -44.85 78.06 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.554 0.741 . . . . 0.0 112.288 -171.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -82.56 -21.14 35.42 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 119.402 -0.332 . . . . 0.0 111.309 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.7 t70 64.03 64.1 0.77 Allowed 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.261 1.024 . . . . 0.0 110.615 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.02 -174.3 4.93 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.7 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -130.49 119.96 23.41 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.217 0.607 . . . . 0.0 110.698 170.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.2 t -70.72 126.37 30.84 Favored 'Isoleucine or valine' 0 C--N 1.353 0.755 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 165.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.47 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.3 t70 -73.54 144.57 46.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 122.564 0.346 . . . . 0.0 110.848 -174.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -51.16 -42.66 60.95 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.067 0.947 . . . . 0.0 112.973 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.83 -19.91 63.45 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.798 0.839 . . . . 0.0 112.701 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.2 pt-20 -102.55 -7.4 21.88 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.82 0.448 . . . . 0.0 111.15 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 58' ' ' ASP . 75.4 mt -85.81 105.39 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.7 t -133.16 170.57 15.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.016 0.926 . . . . 0.0 109.599 174.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.72 -32.11 71.38 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.472 0.654 . . . . 0.0 109.996 170.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.74 -12.58 61.38 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.599 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.438 HG23 HD13 ' A' ' 73' ' ' LEU . 42.1 m -74.72 -42.18 58.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.543 ' HA ' HD22 ' A' ' 73' ' ' LEU . 92.2 m-85 -92.72 20.94 5.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.096 0.958 . . . . 0.0 112.31 -176.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.45 ' HG3' HG22 ' A' ' 69' ' ' THR . 7.6 pt-20 -65.14 -45.21 85.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.292 0.237 . . . . 0.0 110.633 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.45 HG22 ' HG3' ' A' ' 68' ' ' GLU . 11.5 t -150.13 158.53 44.25 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.064 0.546 . . . . 0.0 110.873 -179.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 tp -52.33 -40.34 61.8 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.547 1.139 . . . . 0.0 111.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.96 -41.82 96.52 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 114.607 -1.179 . . . . 0.0 111.794 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.42 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 50.5 m -60.1 -50.29 74.3 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.001 0.52 . . . . 0.0 111.035 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.543 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -58.06 -40.17 80.31 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 122.604 0.361 . . . . 0.0 110.395 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.547 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.92 -48.64 80.9 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.308 1.005 . . . . 0.0 110.632 178.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.12 -45.59 87.03 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 124.042 0.937 . . . . 0.0 111.002 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.475 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.5 m-85 -56.71 -57.35 12.79 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.294 177.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.7 m -67.6 -23.11 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.3 mm-40 -57.39 -51.28 70.06 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.48 -51.84 63.88 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.312 -176.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.57 -48.49 79.21 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 0.0 112.451 -171.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -78.1 -16.72 57.74 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.155 -178.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.5 m -89.42 -8.67 52.56 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.82 0.448 . . . . 0.0 111.493 172.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 173.623 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.484 H313 HG23 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 121.437 0.637 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.415 ' HA ' HE21 ' A' ' 2' ' ' GLN . 0.0 OUTLIER -95.1 -46.59 6.73 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.152 171.279 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -74.83 -17.72 60.56 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 113.549 -1.659 . . . . 0.0 113.507 -164.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.24 -37.72 37.06 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.991 0.916 . . . . 0.0 112.487 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -75.17 -41.1 58.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.712 -174.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.54 66.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.367 0.667 . . . . 0.0 111.414 174.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.7 t -70.46 -50.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.082 0.553 . . . . 0.0 109.536 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -67.08 -27.41 67.34 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.32 -58.56 6.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.011 0.924 . . . . 0.0 109.727 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.3 mt -61.28 -49.77 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.951 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.12 -41.78 89.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.308 0.643 . . . . 0.0 111.126 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.61 -19.99 79.69 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 121.556 -0.354 . . . . 0.0 113.42 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -75.73 -48.64 21.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.949 0.5 . . . . 0.0 110.446 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.47 -48.63 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 123.523 0.729 . . . . 0.0 110.38 -177.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.496 ' HB2' HD11 ' A' ' 17' ' ' LEU . 44.2 mt -84.5 0.04 51.25 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.227 -177.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 66.76 24.84 9.83 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.366 1.066 . . . . 0.0 111.507 170.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.496 HD11 ' HB2' ' A' ' 15' ' ' LEU . 9.6 mp -60.11 -41.31 92.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.222 0.609 . . . . 0.0 110.706 174.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.16 -81.68 0.03 OUTLIER Glycine 0 C--N 1.354 1.546 0 O-C-N 124.196 0.935 . . . . 0.0 114.089 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -87.47 -35.83 18.02 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.026 0.93 . . . . 0.0 110.252 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.09 -28.29 69.98 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.123 0.969 . . . . 0.0 110.904 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.494 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 54.9 pttt -70.33 -31.99 69.53 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.806 0.442 . . . . 0.0 111.864 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -80.02 -31.5 39.6 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.102 0.561 . . . . 0.0 110.726 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.1 t -85.65 -5.88 59.21 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.207 0.603 . . . . 0.0 112.45 -175.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -98.07 155.99 16.87 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.236 0.471 . . . . 0.0 110.084 176.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.8 p -112.94 -175.64 2.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.619 0.767 . . . . 0.0 110.921 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -35.77 76.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.273 0.629 . . . . 0.0 110.944 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.6 m -75.95 -15.8 60.11 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.368 -0.833 . . . . 0.0 112.242 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.9 p -67.82 140.63 56.61 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.859 0.299 . . . . 0.0 110.825 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -84.26 143.06 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 123.782 0.833 . . . . 0.0 109.341 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HA ' HG12 ' A' ' 34' ' ' ILE . 49.2 mt -110.35 -70.27 0.82 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.828 0.451 . . . . 0.0 109.873 178.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.01 112.52 1.22 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.393 1.077 . . . . 0.0 110.699 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 -40.47 2.48 Favored Glycine 0 C--N 1.345 1.081 0 O-C-N 123.541 0.526 . . . . 0.0 112.745 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -78.14 -59.07 2.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.262 0.625 . . . . 0.0 110.475 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 30' ' ' LEU . 31.9 mm -76.26 120.28 80.96 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.32 -13.38 35.69 Favored 'Trans proline' 0 C--N 1.37 1.699 0 C-N-CA 122.726 2.284 . . . . 0.0 112.441 -177.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -86.75 -13.92 43.87 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.53 0.732 . . . . 0.0 111.27 -177.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.41 81.7 5.64 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -96.04 170.88 8.97 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.65 1.58 . . . . 0.0 109.92 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.712 ' HB3' H281 ' A' ' 84' ' ' PNS . 6.1 m -46.56 -67.81 0.25 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.712 1.205 . . . . 0.0 113.019 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.0 mmm -66.13 -24.07 66.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.801 -0.562 . . . . 0.0 111.501 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.42 -37.06 85.82 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 124.069 0.856 . . . . 0.0 112.251 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.605 HG22 ' O ' ' A' ' 39' ' ' SER . 7.7 m -68.7 -37.61 77.77 Favored 'Isoleucine or valine' 0 C--N 1.367 1.347 0 CA-C-N 118.445 0.566 . . . . 0.0 109.776 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -61.18 -45.29 98.88 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.592 0.711 . . . . 0.0 109.374 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.4 -50.14 74.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 113.605 -1.634 . . . . 0.0 113.085 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.41 HG23 ' HA ' ' A' ' 42' ' ' VAL . 26.7 m -71.82 -30.51 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.619 -176.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -63.48 -50.59 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.3 m -53.24 -48.68 68.01 Favored 'General case' 0 C--N 1.351 0.656 0 O-C-N 124.421 1.076 . . . . 0.0 110.929 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.41 -43.74 98.1 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.115 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -57.13 -46.5 82.63 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.463 0.705 . . . . 0.0 110.59 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.88 -44.64 91.16 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.034 0.934 . . . . 0.0 111.222 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 47' ' ' THR . 37.6 mm-40 -59.31 -61.34 2.7 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.63 0.772 . . . . 0.0 111.353 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -67.3 -51.56 51.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.874 -171.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 m-30 -75.2 -16.26 60.5 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.522 0.329 . . . . 0.0 111.551 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.0 t70 68.12 66.73 0.34 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.268 1.027 . . . . 0.0 110.63 175.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.423 ' CE2' HG23 ' A' ' 57' ' ' VAL . 7.7 p90 -157.01 -170.28 3.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.015 172.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.88 138.66 45.71 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 167.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.423 HG23 ' CE2' ' A' ' 55' ' ' PHE . 2.9 t -89.69 122.69 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 176.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.411 ' O ' HG13 ' A' ' 62' ' ' ILE . 18.0 t70 -87.93 153.79 21.02 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.674 0.79 . . . . 0.0 111.281 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.67 -36.9 67.61 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.548 1.139 . . . . 0.0 112.365 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.35 -33.55 76.23 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.228 1.011 . . . . 0.0 111.844 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -96.87 -20.68 17.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.941 0.496 . . . . 0.0 110.918 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 58' ' ' ASP . 53.7 mt -74.76 124.51 32.61 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 174.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.5 t -146.13 -178.7 6.27 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.39 1.076 . . . . 0.0 108.474 165.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.592 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -64.67 -32.41 74.06 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.401 0.619 . . . . 0.0 109.574 168.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -65.94 -12.28 53.63 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.837 178.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.411 HG22 HD11 ' A' ' 73' ' ' LEU . 91.6 m -72.9 -38.17 67.0 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.009 0.523 . . . . 0.0 110.489 174.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.487 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.6 m-85 -97.75 7.05 47.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.16 -47.85 77.44 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.376 0.422 . . . . 0.0 111.232 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.6 p -135.8 166.33 23.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.964 0.506 . . . . 0.0 110.868 173.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.9 tp -59.57 -38.05 80.11 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.072 174.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.1 -35.08 90.96 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.87 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -62.28 -53.08 60.32 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.012 0.525 . . . . 0.0 110.574 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -56.43 -43.48 79.46 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.508 0.505 . . . . 0.0 110.071 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.92 -48.13 82.57 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 124.589 1.18 . . . . 0.0 111.667 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -66.96 -39.03 87.15 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.423 0.452 . . . . 0.0 110.94 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.491 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 24.5 m-85 -57.68 -54.72 43.66 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 176.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.44 -24.38 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.099 0.56 . . . . 0.0 112.051 -178.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.6 mm-40 -57.47 -56.01 27.42 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -60.19 -34.94 74.32 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.546 -174.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 30.9 mmmt -63.85 -56.71 13.33 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.344 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.437 HD22 ' HB2' ' A' ' 80' ' ' LYS . 3.1 mm? -84.22 -13.26 53.15 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -173.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.7 m -102.55 -14.97 16.57 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -175.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.5 p-80 . . . . . 0 N--CA 1.493 1.702 0 CA-C-N 119.02 0.827 . . . . 0.0 110.61 -177.132 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.712 H281 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.438 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.11 -36.22 9.76 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.035 0.934 . . . . 0.0 110.799 177.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.83 -17.57 61.05 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -169.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -51.99 -33.04 36.42 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 123.809 0.844 . . . . 0.0 112.581 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 -41.78 63.96 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.205 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.5 -28.95 65.36 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.917 0.487 . . . . 0.0 111.053 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.403 HG12 ' HB2' ' A' ' 73' ' ' LEU . 78.3 t -67.54 -50.55 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 122.994 0.517 . . . . 0.0 109.927 176.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -67.52 -28.62 67.97 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -60.26 -52.89 63.37 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 123.966 0.791 . . . . 0.0 109.749 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.419 HG23 HD21 ' A' ' 49' ' ' LEU . 85.7 mt -62.92 -55.33 24.3 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 O-C-N 124.219 0.949 . . . . 0.0 111.492 -178.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.64 -34.65 78.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.742 0.417 . . . . 0.0 111.495 -175.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.456 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -78.91 -20.05 71.46 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-O 119.989 -0.34 . . . . 0.0 113.689 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.18 -48.01 25.63 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.033 0.533 . . . . 0.0 109.705 173.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.429 HG12 ' ND2' ' A' ' 44' ' ' ASN . 71.2 t -70.17 -49.77 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.466 1.106 . . . . 0.0 110.929 -176.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -78.21 -9.26 59.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.427 0.691 . . . . 0.0 111.255 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 67.02 44.52 1.94 Allowed 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.543 1.137 . . . . 0.0 111.401 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 7.0 mp -72.29 -35.36 68.66 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.54 1.136 . . . . 0.0 110.68 173.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.24 -91.39 0.37 Allowed Glycine 0 C--N 1.346 1.122 0 CA-C-N 115.727 -0.67 . . . . 0.0 113.494 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -97.06 -21.02 17.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.787 0.835 . . . . 0.0 110.754 -177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.467 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -61.9 -34.25 75.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.392 0.677 . . . . 0.0 109.893 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 56.9 pttt -68.78 -29.84 68.3 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.224 0.61 . . . . 0.0 111.579 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -75.8 -40.74 54.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.164 0.586 . . . . 0.0 110.313 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -85.87 13.32 7.57 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.215 0.606 . . . . 0.0 112.05 -173.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.42 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.6 pp -113.36 163.09 15.29 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 122.011 -0.431 . . . . 0.0 111.206 172.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.9 p -122.81 -173.17 2.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.478 1.111 . . . . 0.0 110.251 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.03 65.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.316 0.646 . . . . 0.0 112.719 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -86.79 0.48 54.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.198 0.599 . . . . 0.0 112.602 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.42 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 97.2 p -73.26 125.68 28.34 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.588 0.355 . . . . 0.0 110.751 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.0 t -76.83 136.22 25.02 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.478 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.3 mt -108.6 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.532 0.333 . . . . 0.0 110.229 -175.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.52 117.02 5.64 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.45 -33.12 6.26 Favored Glycine 0 C--N 1.342 0.91 0 CA-C-N 115.855 -0.612 . . . . 0.0 113.151 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -90.54 -44.73 9.38 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.084 0.554 . . . . 0.0 110.983 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.478 HG12 ' HA ' ' A' ' 30' ' ' LEU . 33.7 mm -79.87 120.3 79.46 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -70.72 -13.77 32.54 Favored 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 122.847 2.364 . . . . 0.0 112.927 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -94.11 -11.65 30.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.363 0.665 . . . . 0.0 111.091 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -82.66 88.9 6.69 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -101.63 174.03 6.15 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.309 1.443 . . . . 0.0 108.932 178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.665 ' HB3' H281 ' A' ' 84' ' ' PNS . 6.2 m -44.78 -65.33 0.54 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.796 1.238 . . . . 0.0 113.45 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.7 mmm -71.31 -16.68 62.46 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.606 -0.684 . . . . 0.0 111.654 -175.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.82 -33.85 71.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.319 0.648 . . . . 0.0 111.539 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.572 HG21 ' O ' ' A' ' 39' ' ' SER . 2.7 m -68.19 -39.4 81.14 Favored 'Isoleucine or valine' 0 C--N 1.371 1.507 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.9 t -64.85 -43.32 96.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.534 0.683 . . . . 0.0 109.904 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.429 ' ND2' HG12 ' A' ' 14' ' ' VAL . 56.3 t30 -66.02 -39.55 90.32 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.91 -1.496 . . . . 0.0 112.287 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 m -70.38 -39.59 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.036 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 42' ' ' VAL . 92.9 mt -61.4 -43.1 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 CA-C-N 118.257 0.48 . . . . 0.0 110.045 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 87.8 m -58.86 -45.13 90.84 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.108 175.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -63.07 -36.75 84.63 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.642 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.419 HD21 HG23 ' A' ' 10' ' ' ILE . 3.5 mm? -60.35 -40.08 89.45 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.496 0.718 . . . . 0.0 110.103 175.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -57.98 -51.02 71.39 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.005 0.816 . . . . 0.0 110.481 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 47' ' ' THR . 7.5 mm-40 -58.62 -45.1 89.95 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 124.161 0.913 . . . . 0.0 111.473 -173.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 17.3 m-85 -81.74 -55.98 4.28 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -172.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -83.82 -18.19 38.47 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.0 58.88 2.58 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.339 1.056 . . . . 0.0 111.384 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -129.29 -171.82 2.59 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.431 172.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.1 m -127.8 111.72 13.96 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.628 166.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.1 t -69.47 112.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.358 0.949 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 173.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 32.9 t70 -77.54 151.71 34.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.179 0.592 . . . . 0.0 111.217 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -60.16 -32.94 71.52 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.604 0.761 . . . . 0.0 112.433 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -71.48 -31.85 67.6 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.296 0.638 . . . . 0.0 111.823 -173.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -85.65 -20.54 29.28 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.744 0.418 . . . . 0.0 110.887 -178.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 68.1 mt -73.07 124.06 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.26 0.624 . . . . 0.0 111.039 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 86.2 p -147.91 175.99 10.52 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.193 0.997 . . . . 0.0 109.448 166.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -61.07 -36.14 78.84 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.636 0.731 . . . . 0.0 110.194 169.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -78.75 -8.63 58.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.114 -176.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -70.71 -37.63 73.57 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.554 ' HA ' HD21 ' A' ' 73' ' ' LEU . 55.2 m-85 -97.58 14.71 25.67 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.406 0.682 . . . . 0.0 112.72 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.69 -44.19 96.87 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 0.0 111.0 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.3 t -144.94 162.21 37.44 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.252 0.621 . . . . 0.0 110.428 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.77 -36.85 77.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.106 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.23 -33.86 87.31 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.96 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 74.4 m -64.67 -53.51 46.31 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 122.89 0.476 . . . . 0.0 110.662 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.554 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -59.01 -39.04 80.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.021 0.201 . . . . 0.0 110.477 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.556 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.03 -45.49 86.86 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 124.073 0.858 . . . . 0.0 110.383 176.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.76 -49.76 76.45 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.957 0.903 . . . . 0.0 110.893 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.448 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 72.9 m-85 -61.59 -48.14 82.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.596 0.358 . . . . 0.0 111.037 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 18.2 m -70.17 -26.79 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.512 0.325 . . . . 0.0 111.627 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 77.6 mm-40 -59.37 -51.86 68.11 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -58.69 -37.6 76.43 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 124.097 0.873 . . . . 0.0 112.052 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.0 mmmt -59.76 -54.96 40.17 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.254 0.55 . . . . 0.0 110.853 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.07 -14.01 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.895 -176.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.3 m -90.15 -21.62 22.13 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.678 0.391 . . . . 0.0 111.567 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 . . . . . 0 N--CA 1.483 1.177 0 C-N-CA 123.318 0.647 . . . . 0.0 109.443 -177.829 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.665 H281 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.32 -41.77 8.09 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.135 0.969 . . . . 0.0 108.432 178.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -82.77 -3.91 57.24 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 113.691 -1.595 . . . . 0.0 112.734 -168.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -52.14 -34.32 44.12 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.941 0.897 . . . . 0.0 112.434 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 8' ' ' ARG . 41.7 tt0 -72.79 -43.21 63.04 Favored 'General case' 0 C--N 1.352 0.686 0 O-C-N 123.579 0.549 . . . . 0.0 110.355 -176.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.62 -31.96 73.27 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.571 0.348 . . . . 0.0 111.124 176.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 85.1 t -68.53 -46.51 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 122.821 0.448 . . . . 0.0 110.461 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HG2' ' HA ' ' A' ' 5' ' ' GLU . 38.9 ptt180 -70.79 -23.12 62.33 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.673 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -63.95 -50.19 69.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.458 HG23 HD23 ' A' ' 49' ' ' LEU . 88.7 mt -61.39 -48.3 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.673 178.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.05 -36.81 85.53 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.052 0.541 . . . . 0.0 110.341 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.516 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.45 -21.05 78.69 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.54 -0.755 . . . . 0.0 113.67 175.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -85.85 -46.01 11.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.952 0.901 . . . . 0.0 111.225 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.7 t -76.86 -55.73 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 123.752 0.821 . . . . 0.0 110.385 -175.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.517 HD12 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -82.93 -9.52 59.26 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.858 -176.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 68.28 63.52 0.36 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.735 1.214 . . . . 0.0 110.796 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.516 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.0 mp -82.01 -36.93 27.3 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.586 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.94 -89.66 0.06 OUTLIER Glycine 0 C--N 1.356 1.688 0 O-C-N 123.632 0.583 . . . . 0.0 113.795 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.94 -40.57 22.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.785 0.834 . . . . 0.0 110.317 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -28.17 63.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.917 1.287 . . . . 0.0 112.298 -170.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.7 4.11 8.45 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -92.16 -46.98 7.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.91 0.484 . . . . 0.0 109.775 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 t -70.48 -29.09 65.54 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.87 -172.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 4.1 pp -84.16 157.42 21.68 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.84 0.456 . . . . 0.0 111.431 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.2 p -137.42 -162.68 1.32 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.357 1.463 . . . . 0.0 108.533 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.83 -23.07 51.04 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.8 m -77.67 -12.02 59.93 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.628 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 35.9 t -62.03 124.74 21.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.742 0.817 . . . . 0.0 111.349 -177.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 67.6 t -74.0 153.97 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 70.9 mt -120.97 -60.11 1.68 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.412 HD21 HD11 ' A' ' 37' ' ' LEU . 33.5 mt -56.73 110.94 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.142 0.577 . . . . 0.0 110.63 169.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.42 -32.56 6.13 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.269 -0.878 . . . . 0.0 113.181 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -76.86 -60.29 2.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.529 0.331 . . . . 0.0 110.18 -179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.509 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 25.1 mm -78.33 116.98 63.46 Favored Pre-proline 0 CA--C 1.542 0.659 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.15 -6.55 18.09 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.324 2.016 . . . . 0.0 112.297 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -97.9 -10.29 24.85 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.69 0.796 . . . . 0.0 111.144 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.509 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.8 tm? -79.0 82.81 5.15 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -177.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -101.79 174.34 6.0 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.417 1.487 . . . . 0.0 109.74 176.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.644 ' HB3' H281 ' A' ' 84' ' ' PNS . 0.5 OUTLIER -43.32 -60.52 1.67 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.209 1.404 . . . . 0.0 112.715 166.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.9 mmt -60.83 -32.49 71.87 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 121.135 0.493 . . . . 0.0 110.822 -178.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.517 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -68.74 -29.33 67.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.648 176.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 39' ' ' SER . 3.3 m -66.96 -37.68 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.875 0.761 . . . . 0.0 109.171 174.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.443 HG22 H381 ' A' ' 84' ' ' PNS . 4.2 t -67.28 -44.64 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-O 121.543 0.687 . . . . 0.0 109.29 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -58.69 -49.5 77.36 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.059 -1.428 . . . . 0.0 112.532 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -70.35 -39.04 76.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.802 -175.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.513 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 89.2 mt -60.15 -46.26 94.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.449 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 88.4 m -57.0 -43.32 81.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 124.065 0.853 . . . . 0.0 110.611 174.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.405 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -69.6 -28.19 65.73 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.265 0.626 . . . . 0.0 112.15 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.508 HD12 HG11 ' A' ' 77' ' ' VAL . 3.6 mm? -61.95 -48.11 81.85 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -56.43 -42.83 78.72 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.005 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 47' ' ' THR . 47.3 mm-40 -60.17 -64.34 0.98 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.879 0.872 . . . . 0.0 111.571 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.428 ' HB2' HD13 ' A' ' 10' ' ' ILE . 48.3 m-85 -66.56 -45.78 78.24 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.838 0.711 . . . . 0.0 112.326 -171.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -83.94 -21.68 31.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 66.29 57.93 0.72 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.458 1.103 . . . . 0.0 111.025 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -140.58 179.48 6.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.157 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -126.44 114.89 18.77 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.1 p -72.48 145.77 11.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 124.944 1.298 . . . . 0.0 110.918 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.1 t70 -87.01 142.22 28.09 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 174.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.4 -36.79 74.29 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -176.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -70.19 -15.98 63.01 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.9 pt-20 -86.91 -33.43 19.72 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.647 0.379 . . . . 0.0 110.34 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 42.9 mt -78.99 129.01 38.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.006 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 t -141.76 -177.68 5.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.957 1.303 . . . . 0.0 107.961 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.73 -27.41 67.6 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -64.84 -13.41 55.99 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.371 1.068 . . . . 0.0 111.659 174.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 89.1 m -76.03 -50.25 15.31 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 170.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.454 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 97.5 m-85 -84.2 8.76 14.71 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.503 ' HG3' HG23 ' A' ' 69' ' ' THR . 10.2 pt-20 -60.04 -42.97 95.58 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 122.47 0.308 . . . . 0.0 110.907 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.503 HG23 ' HG3' ' A' ' 68' ' ' GLU . 10.0 t -150.82 162.53 40.56 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.418 0.628 . . . . 0.0 112.009 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.7 -37.78 82.82 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.506 -1.224 . . . . 0.0 110.754 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.94 -32.46 84.11 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.86 -177.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 54.9 m -70.17 -51.94 27.3 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.265 177.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.41 -46.62 62.98 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.234 0.54 . . . . 0.0 111.105 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -63.68 -39.18 93.69 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.203 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -47.34 83.02 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.953 0.901 . . . . 0.0 109.628 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 59.1 m-85 -61.78 -43.51 98.7 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.207 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.508 HG11 HD12 ' A' ' 49' ' ' LEU . 29.9 m -72.87 -23.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-O 119.007 -0.521 . . . . 0.0 112.228 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 65.0 mm-40 -56.19 -51.17 69.0 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 167.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.421 ' HB2' ' O ' ' A' ' 76' ' ' PHE . 90.6 m-70 -54.33 -49.56 69.44 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.286 0.991 . . . . 0.0 111.832 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 28.1 mmmt -68.18 -43.71 77.53 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -171.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.25 -14.9 52.24 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.699 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.2 m -107.97 -11.62 15.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.173 0.589 . . . . 0.0 112.55 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 . . . . . 0 C--O 1.25 1.128 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.668 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.644 H281 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.438 ' HE2' HD21 ' A' ' 75' ' ' LEU . 2.0 tpt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -36.49 79.07 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.801 0.84 . . . . 0.0 113.026 -166.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.436 ' O ' HG21 ' A' ' 7' ' ' VAL . 2.6 m-70 -73.23 -11.56 60.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 118.187 -0.911 . . . . 0.0 112.282 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.24 -30.83 51.67 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 118.395 0.543 . . . . 0.0 110.879 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.19 -53.14 53.96 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.549 1.14 . . . . 0.0 110.528 -178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.442 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.26 -35.49 79.63 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.393 -0.822 . . . . 0.0 111.252 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -65.82 -51.74 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 O-C-N 123.433 0.458 . . . . 0.0 110.048 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.41 ' HA ' HD13 ' A' ' 11' ' ' LEU . 40.9 ptt180 -68.8 -27.0 65.48 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.041 0.536 . . . . 0.0 110.29 -176.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.6 -48.98 79.36 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 123.96 0.788 . . . . 0.0 109.657 173.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.2 mt -63.15 -47.41 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 124.274 0.984 . . . . 0.0 110.932 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 8' ' ' ARG . 52.2 mt -60.3 -42.79 96.28 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.492 0.717 . . . . 0.0 111.025 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.431 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -77.33 -18.78 77.66 Favored Glycine 0 C--N 1.339 0.72 0 CA-C-N 115.742 -0.663 . . . . 0.0 113.202 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.1 -43.31 43.9 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.225 0.512 . . . . 0.0 109.693 174.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 10' ' ' ILE . 88.1 t -71.8 -60.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -83.05 -3.8 57.65 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.621 -170.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 66.61 55.97 0.76 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.792 1.237 . . . . 0.0 111.733 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -84.11 -29.25 26.91 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.964 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.25 -99.54 1.32 Allowed Glycine 0 C--N 1.35 1.343 0 O-C-N 123.542 0.526 . . . . 0.0 112.52 177.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.15 -23.05 18.09 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.826 0.85 . . . . 0.0 110.389 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.516 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.24 -30.86 71.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 0.0 110.421 -175.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.431 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 60.0 pttt -62.8 -33.61 75.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.309 0.644 . . . . 0.0 111.806 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -88.71 -18.54 27.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.024 0.529 . . . . 0.0 111.315 -172.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -94.52 -1.53 53.25 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.049 0.54 . . . . 0.0 111.244 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.516 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -99.0 148.12 24.32 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 173.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.5 p -118.39 -171.95 2.18 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.528 0.731 . . . . 0.0 111.173 -170.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.06 -23.47 67.46 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.114 0.565 . . . . 0.0 112.458 178.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.1 t -88.01 -17.05 32.03 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.328 0.651 . . . . 0.0 111.753 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.458 ' OG ' ' HB2' ' A' ' 24' ' ' LEU . 79.0 p -77.33 128.06 33.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.44 0.296 . . . . 0.0 110.214 -178.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.4 t -81.38 143.04 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 124.571 1.149 . . . . 0.0 109.772 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.543 ' HA ' HG12 ' A' ' 34' ' ' ILE . 64.4 mt -102.33 -67.81 0.86 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.397 0.679 . . . . 0.0 110.236 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.533 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.2 tt -57.46 115.74 2.92 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.88 0.872 . . . . 0.0 111.442 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.59 -22.54 7.5 Favored Glycine 0 C--N 1.353 1.479 0 CA-C-N 115.747 -0.661 . . . . 0.0 114.272 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -90.1 -47.18 7.98 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.709 0.804 . . . . 0.0 110.687 -176.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.543 HG12 ' HA ' ' A' ' 30' ' ' LEU . 43.8 mm -75.63 122.16 86.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.07 -8.55 23.92 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.797 2.331 . . . . 0.0 113.288 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -90.49 -28.85 18.29 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 173.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.533 HD12 ' HA ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -74.53 94.26 2.6 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -125.74 -166.21 1.53 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 125.246 1.418 . . . . 0.0 107.705 171.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.563 ' HB3' H281 ' A' ' 84' ' ' PNS . 12.9 m -41.82 -69.39 0.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.605 1.562 . . . . 0.0 114.58 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 mmt -70.74 -23.92 62.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.242 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.426 ' O ' HG21 ' A' ' 45' ' ' VAL . . . -60.71 -41.77 95.88 Favored 'General case' 0 C--N 1.345 0.392 0 O-C-N 123.932 0.77 . . . . 0.0 111.405 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -63.13 -42.38 96.33 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.1 t -63.81 -45.6 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.729 0.776 . . . . 0.0 110.354 -176.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -58.23 -47.96 81.88 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.502 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.442 ' O ' HD21 ' A' ' 49' ' ' LEU . 24.8 m -76.01 -25.29 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 119.069 -0.491 . . . . 0.0 112.017 -175.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 42' ' ' VAL . 90.7 mt -62.74 -55.73 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 171.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.7 m -54.98 -46.91 75.14 Favored 'General case' 0 C--N 1.356 0.888 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.795 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.97 89.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.991 0.917 . . . . 0.0 111.621 -177.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -53.89 -43.55 69.75 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.293 0.637 . . . . 0.0 110.071 175.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.435 ' HG2' ' H ' ' A' ' 57' ' ' VAL . 42.9 mt-10 -61.8 -45.4 94.0 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.309 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 47' ' ' THR . 44.1 mm-40 -63.39 -55.18 26.51 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.177 0.591 . . . . 0.0 111.477 -176.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -69.0 -42.06 76.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.147 0.579 . . . . 0.0 112.439 -174.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -82.65 -11.31 58.46 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 66.43 38.02 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.654 1.182 . . . . 0.0 111.69 174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.3 -168.7 1.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.716 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.5 t -133.51 116.99 16.62 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 167.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.435 ' H ' ' HG2' ' A' ' 50' ' ' GLU . 48.0 t -69.75 113.8 6.17 Favored 'Isoleucine or valine' 0 C--N 1.351 0.636 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 173.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.506 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.0 t70 -70.3 148.85 48.02 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.671 0.789 . . . . 0.0 110.784 -173.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -56.97 -41.49 78.44 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.336 0.654 . . . . 0.0 112.491 -176.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.63 -27.29 67.57 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.51 0.724 . . . . 0.0 112.308 -174.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -95.79 -5.42 41.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.241 0.616 . . . . 0.0 111.129 -177.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 58' ' ' ASP . 58.2 mt -83.67 106.82 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 122.735 0.414 . . . . 0.0 110.02 175.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -128.28 173.98 9.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.035 0.934 . . . . 0.0 109.546 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.515 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -67.91 -31.27 70.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.079 0.552 . . . . 0.0 110.149 169.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -67.11 -18.97 65.55 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.396 175.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.5 m -73.68 -37.28 65.28 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.491 ' HA ' HD22 ' A' ' 73' ' ' LEU . 68.1 m-85 -107.83 15.76 24.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.519 0.728 . . . . 0.0 112.196 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.78 -42.69 94.89 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.371 0.419 . . . . 0.0 110.477 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.0 t -146.85 166.18 27.47 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.034 0.534 . . . . 0.0 110.606 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.406 HD21 HD13 ' A' ' 24' ' ' LEU . 61.9 tp -62.47 -35.48 79.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.071 0.549 . . . . 0.0 110.681 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.24 -32.14 79.6 Favored Glycine 0 C--N 1.351 1.402 0 O-C-N 123.688 0.618 . . . . 0.0 112.72 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.4 m -68.4 -52.65 30.61 Favored 'General case' 0 C--N 1.347 0.5 0 C-N-CA 123.161 0.585 . . . . 0.0 110.469 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.491 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.1 mm? -61.57 -42.24 98.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 117.812 0.278 . . . . 0.0 111.497 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.528 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.46 -46.74 80.22 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.071 0.857 . . . . 0.0 110.248 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.438 HD21 ' HE2' ' A' ' 1' ' ' MET . 0.2 OUTLIER -59.9 -49.66 76.83 Favored 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 124.208 1.003 . . . . 0.0 110.599 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.468 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 18.1 m-85 -60.07 -50.47 73.59 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.52 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.71 -28.89 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.652 0.381 . . . . 0.0 111.695 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.528 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 50.2 mm-40 -60.27 -46.79 88.61 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 170.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.27 -29.4 70.49 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.927 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -70.32 -56.61 6.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.101 0.56 . . . . 0.0 111.908 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.21 -14.02 62.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.547 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -82.88 -47.77 11.46 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 122.259 0.224 . . . . 0.0 110.614 170.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.726 -178.425 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.563 H281 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.598 ' HE1' HD22 ' A' ' 75' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.3 -37.8 8.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.341 1.056 . . . . 0.0 110.841 176.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.437 ' O ' HG22 ' A' ' 7' ' ' VAL . 79.4 m-70 -79.93 -16.5 55.16 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -169.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.409 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 2.4 pt? -53.5 -28.67 32.21 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.499 0.59 . . . . 0.0 111.622 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -57.81 -56.54 20.69 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.496 1.518 . . . . 0.0 110.409 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.417 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.41 -28.3 64.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.802 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.437 HG22 ' O ' ' A' ' 3' ' ' HIS . 95.2 t -68.29 -50.6 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.075 0 C-N-CA 122.474 0.31 . . . . 0.0 110.924 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 19.0 ptt85 -70.52 -24.04 62.75 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.415 0.286 . . . . 0.0 110.56 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.14 -48.47 81.46 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.795 170.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 6' ' ' ALA . 81.3 mt -60.48 -57.73 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.936 0.894 . . . . 0.0 111.74 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.447 ' HG ' HG11 ' A' ' 45' ' ' VAL . 9.2 mp -64.31 -34.92 79.25 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 123.083 0.239 . . . . 0.0 110.999 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.549 ' HA3' ' HD2' ' A' ' 21' ' ' LYS . . . -66.51 -34.39 87.55 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-N 116.239 -0.437 . . . . 0.0 113.376 174.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -72.06 -52.05 18.7 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.577 0.751 . . . . 0.0 109.893 -178.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.4 t -66.63 -53.17 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.014 0.926 . . . . 0.0 110.655 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.497 HD13 ' HB1' ' A' ' 41' ' ' ALA . 2.6 mm? -87.91 -5.24 58.66 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 65.1 56.02 1.07 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.996 0.903 . . . . 0.0 110.925 174.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.543 HD13 HD12 ' A' ' 34' ' ' ILE . 4.3 mm? -70.48 -31.7 68.93 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 178.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 73.89 -98.58 0.98 Allowed Glycine 0 C--N 1.342 0.877 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.334 -178.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.69 -11.74 19.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.953 0.901 . . . . 0.0 111.152 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.463 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -72.26 -29.29 63.77 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -178.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.549 ' HD2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -69.15 -10.76 59.23 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 173.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -89.35 -36.94 15.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.116 0.566 . . . . 0.0 110.722 177.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.2 t -76.88 -21.61 54.69 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.647 0.379 . . . . 0.0 111.217 -173.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -86.99 146.84 25.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.8 p -123.72 -169.47 1.95 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.463 1.105 . . . . 0.0 109.218 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.78 72.87 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.611 0.364 . . . . 0.0 110.786 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.8 m -80.78 2.56 25.71 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.627 0.771 . . . . 0.0 112.44 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -95.29 145.57 24.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.84 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -77.95 156.87 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.303 1.041 . . . . 0.0 109.139 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.5 mt -119.87 -62.98 1.42 Allowed 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.902 -0.499 . . . . 0.0 110.234 177.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.461 HD22 HD11 ' A' ' 37' ' ' LEU . 93.8 mt -55.34 112.3 1.07 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.307 0.643 . . . . 0.0 110.984 172.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.49 -33.48 4.95 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.017 -0.538 . . . . 0.0 113.328 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.43 -41.31 69.66 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.165 0.586 . . . . 0.0 110.174 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.543 HD12 HD13 ' A' ' 17' ' ' LEU . 20.3 mm -90.35 119.22 69.19 Favored Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 174.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.86 -12.28 32.41 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.685 2.256 . . . . 0.0 112.79 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -93.15 -23.87 18.44 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.169 0.588 . . . . 0.0 111.384 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.461 HD11 HD22 ' A' ' 31' ' ' LEU . 1.2 tm? -79.46 82.32 5.6 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -176.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' O ' HG12 ' A' ' 42' ' ' VAL . 17.9 t70 -115.68 -155.34 0.57 Allowed 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 125.081 1.352 . . . . 0.0 108.739 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.573 ' O ' HG22 ' A' ' 42' ' ' VAL . 36.0 t -54.26 -71.7 0.07 Allowed 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.078 1.351 . . . . 0.0 113.991 -169.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.67 -24.08 67.64 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.649 -0.657 . . . . 0.0 112.016 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.497 ' HB1' HD13 ' A' ' 15' ' ' LEU . . . -67.87 -37.97 82.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.45 0.7 . . . . 0.0 111.678 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' SER . 6.3 m -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 C--N 1.369 1.456 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 174.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.444 HG22 H311 ' A' ' 84' ' ' PNS . 10.7 t -70.33 -40.49 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.829 -176.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -63.81 -41.22 97.93 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.233 1.013 . . . . 0.0 112.076 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.447 HG11 ' HG ' ' A' ' 11' ' ' LEU . 21.7 m -74.37 -33.06 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.355 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.452 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.8 mt -59.43 -47.28 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 41.5 m -59.18 -43.48 92.16 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.109 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -32.26 73.54 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.679 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.8 -45.58 91.89 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 2.4 mm-40 -57.39 -49.34 76.5 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.617 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 47' ' ' THR . 17.6 mm-40 -67.02 -52.45 42.24 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.465 0.706 . . . . 0.0 111.995 -174.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.66 -60.66 3.33 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.7 0.8 . . . . 0.0 111.718 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -78.02 -17.77 56.68 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.232 0.332 . . . . 0.0 111.43 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 65.6 62.43 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.768 1.227 . . . . 0.0 109.82 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.38 -166.61 2.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.656 176.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.5 m -133.01 113.09 12.4 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 123.204 0.602 . . . . 0.0 109.974 167.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 70.7 t -73.17 108.84 4.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.713 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 167.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 22.9 t70 -63.08 148.91 46.48 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.509 -171.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.3 -32.09 71.94 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.895 0.478 . . . . 0.0 112.0 -175.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -70.19 -27.92 64.89 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.535 0.734 . . . . 0.0 111.533 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.1 pt-20 -92.68 -12.48 31.39 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.183 0.193 . . . . 0.0 110.973 -178.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 58' ' ' ASP . 45.5 mt -84.91 106.94 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 122.92 0.488 . . . . 0.0 110.149 175.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.2 p -130.0 179.68 5.73 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.361 1.064 . . . . 0.0 108.703 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.37 -34.5 78.31 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.014 174.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -67.92 -12.71 61.23 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.314 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -70.65 -40.09 73.25 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.829 0.451 . . . . 0.0 110.603 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.601 ' HB2' ' S44' ' A' ' 84' ' ' PNS . 52.5 m-85 -107.61 18.26 21.66 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.439 ' HG3' HG23 ' A' ' 69' ' ' THR . 11.1 pt-20 -61.73 -38.35 87.58 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.439 HG23 ' HG3' ' A' ' 68' ' ' GLU . 8.3 t -146.24 160.6 41.77 Favored 'General case' 0 C--O 1.25 1.103 0 C-N-CA 123.315 0.646 . . . . 0.0 110.729 175.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.5 tp -63.6 -29.62 70.84 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.67 -38.22 95.37 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.992 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.435 ' H ' HG22 ' A' ' 69' ' ' THR . 64.4 m -58.67 -51.53 69.52 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -58.37 -45.48 88.19 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 123.667 0.605 . . . . 0.0 111.194 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -55.45 -45.45 76.86 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.708 1.255 . . . . 0.0 110.143 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.598 HD22 ' HE1' ' A' ' 1' ' ' MET . 3.9 mm? -66.47 -43.57 85.09 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.724 0.64 . . . . 0.0 111.548 179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.497 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 21.3 m-85 -54.32 -55.78 25.04 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.5 m -73.39 -24.79 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.148 0.979 . . . . 0.0 112.301 -174.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.584 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.0 mm-40 -55.64 -54.95 37.88 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 168.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -69.08 -32.08 71.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.765 -171.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.71 -54.96 41.0 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.23 0.612 . . . . 0.0 110.721 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -80.73 -13.55 58.89 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.777 -177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.2 m -72.01 -31.16 65.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.362 0.265 . . . . 0.0 110.413 170.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 35.1 m170 . . . . . 0 CA--C 1.549 0.924 0 C-N-CA 123.312 0.645 . . . . 0.0 109.416 179.221 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.601 ' S44' ' HB2' ' A' ' 67' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.543 ' HE2' HD22 ' A' ' 75' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -94.51 -53.96 3.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 122.05 0.929 . . . . 0.0 108.741 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.401 ' O ' HG23 ' A' ' 7' ' ' VAL . 97.6 m-70 -70.8 -17.71 62.76 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.0 -1.909 . . . . 0.0 113.419 -164.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -50.09 -34.35 21.55 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -72.3 -42.37 65.55 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 122.511 0.324 . . . . 0.0 110.617 -176.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.83 -33.88 76.87 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.214 0.605 . . . . 0.0 111.07 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 3' ' ' HIS . 83.9 t -66.66 -50.79 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.153 0.581 . . . . 0.0 109.767 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.9 ptt180 -68.6 -26.83 65.57 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.711 0.404 . . . . 0.0 110.634 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.412 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 32.0 t30 -61.64 -50.01 74.24 Favored 'General case' 0 C--O 1.25 1.09 0 C-N-CA 123.996 0.919 . . . . 0.0 109.758 175.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.19 -50.06 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.719 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.3 mt -58.86 -39.89 82.7 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.433 0.693 . . . . 0.0 111.475 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.424 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -71.98 -28.08 69.29 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-O 119.851 -0.416 . . . . 0.0 113.337 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -75.41 -39.51 58.88 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 117.031 0.415 . . . . 0.0 110.686 175.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.2 t -75.18 -54.29 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.005 0.522 . . . . 0.0 110.493 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.538 HD12 ' HB1' ' A' ' 41' ' ' ALA . 2.4 mm? -84.78 1.44 46.7 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.172 0.589 . . . . 0.0 112.072 -176.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 65.82 46.61 2.26 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 122.22 1.009 . . . . 0.0 111.245 170.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 mp -77.52 -34.95 53.88 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.873 172.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.49 -91.24 0.25 Allowed Glycine 0 C--N 1.352 1.455 0 O-C-N 123.912 0.757 . . . . 0.0 113.072 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -92.5 -28.92 16.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.984 0.914 . . . . 0.0 110.657 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HA ' HG21 ' A' ' 23' ' ' THR . 0.2 OUTLIER -65.54 -24.64 67.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.692 0.797 . . . . 0.0 111.435 -173.492 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.424 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 61.0 pttt -65.18 -27.03 68.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.847 0.459 . . . . 0.0 111.817 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.8 t-80 -92.01 -22.96 19.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.774 0.43 . . . . 0.0 110.877 -175.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.406 HG21 ' HA ' ' A' ' 20' ' ' ARG . 7.2 t -86.15 -1.05 57.06 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.359 0.264 . . . . 0.0 111.187 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -103.64 156.43 17.8 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.956 0.408 . . . . 0.0 110.146 172.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.3 p -121.51 -172.34 2.4 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.216 1.006 . . . . 0.0 110.178 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.3 81.23 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 t -75.18 -3.73 34.7 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.002 0.521 . . . . 0.0 112.194 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.1 t -67.68 137.1 55.29 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.001 0.521 . . . . 0.0 110.498 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -86.7 150.69 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.918 0.887 . . . . 0.0 109.863 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.3 mt -109.02 -66.93 1.01 Allowed 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.5 mt -54.41 121.39 8.21 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.842 0.857 . . . . 0.0 111.264 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.76 -28.56 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 119.533 -0.593 . . . . 0.0 113.809 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -77.71 -66.21 0.87 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.498 0.649 . . . . 0.0 110.021 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.16 119.27 76.81 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.192 -175.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.99 -15.52 36.26 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 122.315 2.01 . . . . 0.0 111.899 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -88.04 -29.26 20.81 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.944 0.898 . . . . 0.0 110.152 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.8 100.57 3.48 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -132.52 -156.83 0.78 Allowed 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.706 ' HB2' H301 ' A' ' 84' ' ' PNS . 58.0 p -67.46 -54.52 19.5 Favored 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -167.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 97.0 mmm -61.55 -27.52 68.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.691 -1.255 . . . . 0.0 111.263 177.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.538 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -68.24 -33.73 74.93 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.795 175.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 39' ' ' SER . 5.9 m -64.68 -37.62 80.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 118.791 0.723 . . . . 0.0 109.645 175.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.49 -48.15 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 121.499 0.666 . . . . 0.0 109.956 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -60.41 -45.84 92.15 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 113.799 -1.546 . . . . 0.0 112.634 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 32.6 m -71.05 -31.94 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 119.031 -0.509 . . . . 0.0 111.575 -176.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.425 HD12 HD12 ' A' ' 62' ' ' ILE . 82.3 mt -63.48 -50.57 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -50.91 -48.76 60.52 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.508 1.13 . . . . 0.0 110.922 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.44 -46.82 84.5 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.798 -178.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.2 -45.23 75.86 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.576 0.75 . . . . 0.0 110.366 176.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.5 -40.1 96.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.823 0.849 . . . . 0.0 112.05 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -65.48 -52.52 52.27 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.43 0.692 . . . . 0.0 112.139 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.49 -49.48 40.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -176.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -75.45 -16.76 60.3 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.834 0.454 . . . . 0.0 111.755 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.49 46.76 3.2 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.432 1.11 . . . . 0.0 110.273 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.93 -170.78 2.58 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.483 175.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.9 t -126.08 117.14 22.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 166.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.12 108.54 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.76 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.577 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.2 t70 -72.8 144.23 47.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.463 0.705 . . . . 0.0 111.286 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.55 -38.7 64.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.875 0.87 . . . . 0.0 112.626 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -71.6 -21.19 61.89 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.218 0.607 . . . . 0.0 111.99 -172.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 10.8 pt-20 -94.6 -17.39 22.36 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.425 HD12 HD12 ' A' ' 46' ' ' ILE . 76.7 mt -81.05 109.39 15.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 123.185 0.594 . . . . 0.0 110.078 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.3 t -130.11 170.4 14.08 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 164.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.91 76.06 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -63.95 -18.97 64.78 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.498 0.719 . . . . 0.0 112.243 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.6 m -64.47 -38.81 92.3 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.283 0.633 . . . . 0.0 110.097 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.528 ' HA ' HD23 ' A' ' 73' ' ' LEU . 77.3 m-85 -96.17 19.45 11.77 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.34 1.056 . . . . 0.0 112.623 -177.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.64 -48.9 77.36 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 123.091 0.244 . . . . 0.0 110.447 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.6 p -142.05 162.59 35.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.816 0.847 . . . . 0.0 110.395 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 60.9 tp -56.29 -40.32 74.12 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.017 0.927 . . . . 0.0 111.386 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.74 -35.45 92.03 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 114.513 -1.222 . . . . 0.0 112.034 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 m -62.2 -51.03 69.43 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 122.959 0.504 . . . . 0.0 110.483 177.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.07 -42.56 80.84 Favored 'General case' 0 C--N 1.365 1.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.887 176.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.74 -43.25 85.24 Favored 'General case' 0 C--O 1.21 -1.018 0 O-C-N 124.686 1.241 . . . . 0.0 110.973 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.543 HD22 ' HE2' ' A' ' 1' ' ' MET . 3.0 mm? -61.87 -51.47 68.07 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.864 0.727 . . . . 0.0 110.791 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.52 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 68.5 m-85 -55.69 -49.7 72.25 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 123.668 0.605 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.2 m -72.64 -24.86 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.163 0.585 . . . . 0.0 112.018 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.5 mm-40 -56.82 -53.73 54.53 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 169.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -58.69 -43.24 89.93 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.487 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -53.52 -59.02 5.13 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 124.118 0.886 . . . . 0.0 112.157 -177.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -79.22 -13.89 59.41 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.121 -174.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.2 m -80.33 -10.56 59.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.751 0.42 . . . . 0.0 111.478 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.18 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.706 H301 ' HB2' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -36.71 -47.36 0.66 Allowed 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 115.903 1.816 . . . . 0.0 115.903 -162.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.404 ' O ' HG23 ' A' ' 7' ' ' VAL . 39.1 m-70 -68.48 -25.98 65.25 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.47 -30.78 8.69 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 123.925 0.89 . . . . 0.0 112.776 -179.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.86 -50.58 66.05 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 124.315 1.046 . . . . 0.0 110.797 -176.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.22 -25.7 55.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.882 -179.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 3' ' ' HIS . 70.5 t -67.29 -49.59 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -71.55 -24.46 61.94 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.096 0.558 . . . . 0.0 110.3 -178.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.429 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 6.4 t30 -60.95 -50.26 74.12 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.252 0.621 . . . . 0.0 109.666 171.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.35 -46.86 95.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.481 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.2 mt -62.71 -42.51 99.68 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.01 0.524 . . . . 0.0 110.494 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.568 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -68.17 -22.15 74.23 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.436 -0.802 . . . . 0.0 113.239 178.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -84.3 -47.44 10.75 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.372 0.669 . . . . 0.0 111.504 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.16 -58.24 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.455 0.702 . . . . 0.0 110.447 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.5 mm? -80.76 -14.02 58.46 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.792 0.437 . . . . 0.0 110.605 -175.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 67.16 64.47 0.44 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.338 1.055 . . . . 0.0 109.714 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.477 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 3.6 mm? -79.33 -27.04 42.07 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.386 -0.825 . . . . 0.0 108.904 164.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.422 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 64.43 -100.82 0.45 Allowed Glycine 0 C--N 1.354 1.55 0 O-C-N 123.664 0.602 . . . . 0.0 113.636 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -89.09 -23.63 22.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.955 0.902 . . . . 0.0 110.795 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.424 ' HD2' HD11 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -70.81 -22.6 62.33 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.573 0.749 . . . . 0.0 111.003 -176.41 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.568 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 22.8 pttm -63.99 -23.6 67.4 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.138 -0.351 . . . . 0.0 110.927 173.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -80.69 -23.83 39.3 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.364 0.666 . . . . 0.0 111.485 -178.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.4 t -94.43 -15.72 24.03 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -91.27 149.48 21.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 81.4 p -118.4 -169.89 1.79 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.361 1.064 . . . . 0.0 109.36 -177.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.17 63.8 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 122.927 0.491 . . . . 0.0 112.195 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -74.16 -16.53 60.99 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.978 0.911 . . . . 0.0 112.452 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.6 p -66.51 123.11 19.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.03 0.532 . . . . 0.0 111.043 -176.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.5 t -75.98 148.67 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 175.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.5 mt -113.83 -67.65 0.98 Allowed 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.076 -0.39 . . . . 0.0 110.145 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.89 111.37 1.14 Allowed 'General case' 0 C--N 1.35 0.625 0 C-N-CA 122.98 0.512 . . . . 0.0 110.926 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 -34.62 4.98 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-N 115.216 -0.902 . . . . 0.0 113.191 178.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -80.76 -45.57 16.82 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.266 0.626 . . . . 0.0 110.856 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 23.4 mm -90.67 116.15 65.77 Favored Pre-proline 0 C--O 1.243 0.734 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 177.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.15 -4.86 14.71 Favored 'Trans proline' 0 C--N 1.368 1.583 0 C-N-CA 122.446 2.097 . . . . 0.0 112.401 -177.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 14.4 mm-40 -89.26 -18.42 27.05 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.397 0.679 . . . . 0.0 110.151 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 56.9 tp -83.63 87.64 7.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.597 0.713 . . . . 0.0 109.189 -177.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -85.53 173.14 10.42 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.94 1.296 . . . . 0.0 110.287 176.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.635 ' O ' HG23 ' A' ' 42' ' ' VAL . 40.9 t -49.32 -65.21 0.61 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 125.337 1.455 . . . . 0.0 112.231 169.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.0 mmt -60.88 -23.76 65.44 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.306 -0.871 . . . . 0.0 111.981 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.14 -28.39 62.22 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 39' ' ' SER . 4.3 m -66.16 -37.53 79.95 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.457 HG22 H311 ' A' ' 84' ' ' PNS . 3.0 t -67.0 -39.45 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.85 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -59.66 -47.4 85.76 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.756 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.48 -30.46 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.753 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.473 HD11 HD11 ' A' ' 62' ' ' ILE . 97.0 mt -64.5 -48.19 86.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.457 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.7 m -58.74 -44.71 90.57 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.267 0.979 . . . . 0.0 110.532 177.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.97 89.35 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.129 178.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -58.2 -45.77 87.0 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.146 0.578 . . . . 0.0 109.635 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.5 mm-40 -51.5 -49.25 62.24 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 124.325 1.015 . . . . 0.0 110.037 175.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 47' ' ' THR . 25.4 mm-40 -62.1 -66.32 0.56 Allowed 'General case' 0 C--N 1.353 0.727 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.695 -173.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -70.6 -37.14 73.85 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -168.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -88.33 -14.84 37.21 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.325 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 63.79 46.12 4.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.28 1.032 . . . . 0.0 111.548 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.493 ' CZ ' HG22 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -141.52 -171.94 3.42 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.316 -179.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 t -126.0 130.91 52.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 122.918 0.487 . . . . 0.0 110.149 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.493 HG22 ' CZ ' ' A' ' 55' ' ' PHE . 2.6 t -86.31 118.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 172.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.475 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 27.0 t70 -76.08 144.8 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.4 0.68 . . . . 0.0 111.838 -170.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -55.22 -40.06 70.4 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.131 0.973 . . . . 0.0 113.377 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.34 -32.32 68.41 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.276 0.631 . . . . 0.0 112.068 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.4 pt-20 -85.96 -23.62 26.85 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.473 HD11 HD11 ' A' ' 46' ' ' ILE . 68.9 mt -72.25 110.12 5.05 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t -139.76 175.82 9.25 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 171.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.9 71.61 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -63.97 -21.4 66.47 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.143 0.977 . . . . 0.0 112.26 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.451 HG21 HD12 ' A' ' 73' ' ' LEU . 20.7 m -81.97 -41.13 21.21 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.189 0.595 . . . . 0.0 110.17 175.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.487 ' HA ' HD21 ' A' ' 73' ' ' LEU . 61.9 m-85 -101.02 7.25 43.57 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.556 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -62.33 -41.24 98.39 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.948 0.499 . . . . 0.0 111.426 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.556 HG22 ' HG3' ' A' ' 68' ' ' GLU . 7.1 t -148.6 154.76 40.17 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.518 0.727 . . . . 0.0 110.052 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.2 tp -56.21 -33.02 64.94 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.201 1.0 . . . . 0.0 111.604 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.18 -43.25 99.64 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.531 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -61.88 -44.14 97.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.968 0.507 . . . . 0.0 111.05 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.5 mm? -59.01 -47.57 84.71 Favored 'General case' 0 C--N 1.363 1.166 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.601 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -53.41 -52.86 58.01 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 124.624 1.203 . . . . 0.0 110.031 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.1 -45.15 93.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.11 0.964 . . . . 0.0 112.224 -174.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.455 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.7 m-85 -60.44 -49.89 75.77 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.256 0.222 . . . . 0.0 110.867 177.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.2 m -71.39 -23.84 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 122.521 0.329 . . . . 0.0 111.132 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 81.8 mm-40 -56.86 -50.48 72.33 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -57.79 -47.96 81.07 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.108 0.88 . . . . 0.0 110.733 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.6 mmmt -62.7 -55.01 30.71 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.209 -172.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.69 -12.24 60.95 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.511 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 52.6 m -89.51 -27.17 20.49 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 123.057 0.543 . . . . 0.0 111.49 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.009 -179.224 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.457 H311 HG22 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.4 ' N ' ' SD ' ' A' ' 1' ' ' MET . 3.8 mpp? . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.767 0.318 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -92.25 -45.59 8.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.289 1.042 . . . . 0.0 108.216 176.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -79.48 -9.84 59.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 113.498 -1.683 . . . . 0.0 113.597 -164.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -53.13 -30.27 35.86 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.632 0.651 . . . . 0.0 112.341 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.68 -51.67 61.26 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.048 0.939 . . . . 0.0 110.793 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.473 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.56 -35.55 75.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.429 -177.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.2 t -63.91 -50.34 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 122.923 0.489 . . . . 0.0 109.814 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -67.88 -28.65 67.7 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.773 0.429 . . . . 0.0 110.461 -177.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -61.89 -48.77 79.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.656 0.782 . . . . 0.0 109.881 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.5 mt -59.13 -55.24 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.191 0.996 . . . . 0.0 110.995 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.37 -45.2 88.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.116 -174.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.455 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.37 -19.48 79.83 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 116.265 -0.425 . . . . 0.0 113.536 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.8 -38.33 58.29 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.983 0.391 . . . . 0.0 110.104 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -75.29 -56.43 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.529 0.732 . . . . 0.0 110.37 -178.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.4 mm? -81.75 2.19 31.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.513 0.725 . . . . 0.0 112.031 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.6 34.49 2.72 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.434 1.093 . . . . 0.0 111.897 168.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.427 ' HG ' ' HD2' ' A' ' 20' ' ' ARG . 6.0 mp -68.12 -33.71 75.01 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.872 0.869 . . . . 0.0 111.256 177.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.26 -95.13 0.57 Allowed Glycine 0 C--N 1.351 1.411 0 O-C-N 123.463 0.477 . . . . 0.0 113.095 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -96.33 -24.7 16.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.0 0.92 . . . . 0.0 110.434 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.478 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.1 OUTLIER -61.68 -28.74 69.61 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.424 0.69 . . . . 0.0 111.423 -176.103 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.455 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.2 pttt -65.98 -26.25 67.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.376 0.67 . . . . 0.0 112.224 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -96.73 -20.93 17.88 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.272 0.629 . . . . 0.0 110.998 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.478 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.1 t -87.2 4.96 40.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.769 0.427 . . . . 0.0 111.38 179.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -107.69 169.87 8.33 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.376 0.67 . . . . 0.0 109.684 171.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.5 p -127.18 -171.38 2.4 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 0.0 109.56 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.74 -31.54 70.86 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.907 0.483 . . . . 0.0 112.016 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -73.4 -4.93 36.58 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -71.6 129.74 39.46 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.03 0.532 . . . . 0.0 110.835 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.2 t -73.63 155.33 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 124.409 1.083 . . . . 0.0 108.72 171.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 27.3 mt -124.59 -67.13 0.93 Allowed 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 68' ' ' GLU . 5.2 tt -64.96 110.86 2.6 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 172.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.98 -32.13 7.83 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 123.477 0.486 . . . . 0.0 112.73 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -84.31 -65.41 1.01 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.78 0.832 . . . . 0.0 110.434 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.4 mm -71.86 118.12 63.96 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.527 -171.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.92 -4.13 14.85 Favored 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 122.559 2.173 . . . . 0.0 112.442 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 37.7 mm-40 -99.32 -10.24 22.56 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.318 1.047 . . . . 0.0 111.045 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -78.29 82.95 4.56 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -91.85 169.63 10.53 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.587 1.555 . . . . 0.0 110.439 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.553 ' O ' HG21 ' A' ' 42' ' ' VAL . 45.9 t -44.25 -65.73 0.48 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 126.508 1.923 . . . . 0.0 112.637 170.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.411 ' SD ' H311 ' A' ' 84' ' ' PNS . 83.4 mmm -68.03 -21.73 65.0 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.896 -0.503 . . . . 0.0 111.522 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -74.49 -23.87 58.93 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 118.273 -0.87 . . . . 0.0 112.053 174.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.553 HG21 ' O ' ' A' ' 39' ' ' SER . 2.9 m -67.96 -39.55 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 171.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 t -63.35 -44.46 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.162 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.06 -44.37 96.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.306 -1.316 . . . . 0.0 112.887 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -74.2 -30.37 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-O 119.318 -0.373 . . . . 0.0 111.595 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.512 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -61.56 -55.86 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.458 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.9 m -56.12 -39.83 72.82 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 124.629 1.206 . . . . 0.0 111.369 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.4 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -64.69 -46.01 84.19 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.767 0.827 . . . . 0.0 111.69 178.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -54.96 -44.8 74.7 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.328 0.651 . . . . 0.0 110.244 174.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 10.2 mm-40 -53.72 -50.02 66.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.524 1.129 . . . . 0.0 111.447 176.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.6 mm-40 -64.84 -55.8 17.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.542 0.737 . . . . 0.0 111.954 -174.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.4 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 56.5 m-85 -62.6 -56.02 21.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.365 0.666 . . . . 0.0 111.954 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.39 -9.74 59.66 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.2 t70 67.15 35.4 4.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 124.502 1.121 . . . . 0.0 111.106 169.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -173.6 3.44 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.262 0.625 . . . . 0.0 110.772 -171.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.4 m -128.9 113.43 15.22 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.382 0.673 . . . . 0.0 111.362 172.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.74 118.3 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 164.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.571 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 20.7 t70 -72.28 145.88 47.57 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.175 0.443 . . . . 0.0 109.98 -174.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.46 -25.98 67.75 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 121.706 -0.621 . . . . 0.0 112.468 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -76.44 -7.2 54.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.952 0.501 . . . . 0.0 112.071 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.9 pt-20 -111.29 -20.25 12.36 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.825 0.45 . . . . 0.0 110.575 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 58' ' ' ASP . 56.3 mt -77.69 114.58 18.38 Favored 'Isoleucine or valine' 0 C--N 1.357 0.928 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 175.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.417 ' O ' ' S44' ' A' ' 84' ' ' PNS . 88.6 p -131.75 177.22 7.69 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.676 1.191 . . . . 0.0 108.127 168.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.04 73.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.676 0.75 . . . . 0.0 109.756 171.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -69.79 -11.37 60.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.261 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -80.14 -40.46 27.34 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 122.797 0.439 . . . . 0.0 110.023 173.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.554 ' HA ' HD23 ' A' ' 73' ' ' LEU . 37.7 m-85 -99.31 14.03 31.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.548 0.339 . . . . 0.0 111.775 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 11.4 pt-20 -60.95 -40.39 93.11 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 123.786 0.679 . . . . 0.0 112.0 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.2 m -151.82 150.11 29.76 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.096 0.958 . . . . 0.0 109.796 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 tp -53.54 -42.75 67.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.125 0.97 . . . . 0.0 111.861 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.78 -38.23 91.7 Favored Glycine 0 C--N 1.341 0.822 0 O-C-N 124.534 1.146 . . . . 0.0 112.251 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m -58.79 -53.52 57.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.217 0.607 . . . . 0.0 110.268 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.554 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.26 -39.01 91.48 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.385 0.274 . . . . 0.0 110.816 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.598 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.8 -46.23 91.32 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 124.493 1.121 . . . . 0.0 110.334 -177.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -65.07 -44.39 89.11 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.885 0.741 . . . . 0.0 110.883 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.462 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 15.9 m-85 -56.61 -46.9 80.65 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.73 0.412 . . . . 0.0 111.06 179.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.8 m -75.3 -24.63 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 122.832 0.453 . . . . 0.0 111.596 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.5 mm-40 -57.53 -43.58 84.47 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 169.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -67.07 -55.88 12.41 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.211 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -63.82 -54.21 38.63 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.698 0.799 . . . . 0.0 112.235 -168.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.82 -17.63 63.4 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m -97.2 -33.34 11.51 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.655 0.382 . . . . 0.0 111.191 177.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 . . . . . 0 C--O 1.249 1.06 0 C-N-CA 123.979 0.912 . . . . 0.0 109.113 -173.42 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.45 H421 HD13 ' A' ' 46' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.695 0.283 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.02 -50.98 3.99 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.58 0.752 . . . . 0.0 111.074 172.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -82.09 0.31 41.2 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.664 -171.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -55.38 -34.76 64.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 123.53 0.519 . . . . 0.0 111.771 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -68.52 -45.01 73.36 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.834 0.709 . . . . 0.0 110.593 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.79 -33.73 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.096 0.559 . . . . 0.0 111.03 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.5 t -66.84 -49.95 69.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 122.872 0.469 . . . . 0.0 109.772 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.406 ' HG3' ' NZ ' ' A' ' 21' ' ' LYS . 36.3 ptt180 -70.8 -22.18 62.39 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.172 0.589 . . . . 0.0 110.877 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -65.05 -52.89 53.25 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.58 0.752 . . . . 0.0 109.57 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.64 -44.62 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.948 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 65.2 mt -63.38 -44.12 95.65 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.697 0.76 . . . . 0.0 110.277 175.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.541 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -66.72 -19.18 69.06 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 114.665 -1.152 . . . . 0.0 113.582 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -90.83 -52.73 4.72 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.243 0.617 . . . . 0.0 110.788 176.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 84.7 t -68.42 -47.24 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.981 0.912 . . . . 0.0 110.815 -173.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.612 HD13 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -83.75 -14.29 51.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.768 0.427 . . . . 0.0 110.791 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 63.26 62.72 0.96 Allowed 'General case' 0 C--N 1.355 0.825 0 C-N-CA 124.446 1.099 . . . . 0.0 110.286 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.541 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 10.0 mp -72.88 -34.34 66.64 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 114.915 -1.038 . . . . 0.0 109.2 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.35 -94.61 0.27 Allowed Glycine 0 C--N 1.353 1.492 0 O-C-N 123.908 0.755 . . . . 0.0 112.418 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -92.95 -18.49 22.67 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.521 0.728 . . . . 0.0 110.614 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.457 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.4 -31.43 72.53 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.731 0.412 . . . . 0.0 110.19 -178.381 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.406 ' NZ ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -70.0 -26.23 63.97 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.763 0.425 . . . . 0.0 111.823 174.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -70.58 -48.4 55.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.2 t -77.42 -7.21 55.79 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.784 -167.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.636 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 3.9 pp -103.22 157.2 17.17 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.679 0.392 . . . . 0.0 111.179 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 76.2 p -114.57 -169.54 1.56 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.327 1.051 . . . . 0.0 109.472 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.0 69.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.146 0.578 . . . . 0.0 111.35 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -69.54 -12.74 61.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.843 0.857 . . . . 0.0 112.847 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.636 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 46.0 t -59.21 134.56 57.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.972 0.909 . . . . 0.0 111.856 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -83.71 146.15 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.496 ' HA ' HG12 ' A' ' 34' ' ' ILE . 66.7 mt -114.27 -72.65 0.69 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.908 0.483 . . . . 0.0 110.642 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.35 113.36 2.87 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.23 -31.42 8.72 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-N 115.753 -0.658 . . . . 0.0 113.053 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -87.81 -57.61 2.88 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.838 0.455 . . . . 0.0 110.583 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.496 HG12 ' HA ' ' A' ' 30' ' ' LEU . 17.6 mm -71.74 119.82 76.44 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.45 -16.86 30.75 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.279 1.986 . . . . 0.0 111.807 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -86.88 -21.33 26.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.491 0.717 . . . . 0.0 110.902 -177.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -74.39 86.1 2.0 Allowed 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -98.8 173.73 6.73 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.282 1.433 . . . . 0.0 109.731 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.659 ' HB3' H281 ' A' ' 84' ' ' PNS . 1.4 m -46.13 -64.52 0.73 Allowed 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 125.154 1.382 . . . . 0.0 113.22 169.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.7 mmt -63.71 -27.48 69.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 121.189 0.519 . . . . 0.0 110.928 -176.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.612 ' HB1' HD13 ' A' ' 15' ' ' LEU . . . -64.95 -35.96 82.84 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.583 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 39' ' ' SER . 3.7 m -66.47 -36.04 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-N 118.469 0.577 . . . . 0.0 109.644 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.44 HG22 H381 ' A' ' 84' ' ' PNS . 8.0 t -64.85 -47.37 88.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 CA-C-O 121.391 0.615 . . . . 0.0 109.9 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -58.72 -46.09 88.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.185 -1.371 . . . . 0.0 112.954 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.1 -33.45 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.977 -0.535 . . . . 0.0 111.722 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 78.8 mt -62.79 -51.55 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 67.6 m -52.25 -44.52 64.93 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.639 1.212 . . . . 0.0 110.95 177.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.67 -48.89 79.78 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.755 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.5 -46.05 66.48 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.684 0.794 . . . . 0.0 110.592 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 5.8 mm-40 -56.34 -47.86 77.92 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.462 1.105 . . . . 0.0 111.05 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' THR . 24.0 mm-40 -65.28 -52.24 55.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.662 0.785 . . . . 0.0 111.736 -176.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -71.2 -38.25 72.06 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.8 -171.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -94.02 -8.08 40.91 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.776 0.43 . . . . 0.0 111.893 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 67.36 28.23 7.91 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.594 1.158 . . . . 0.0 111.963 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -126.17 -177.67 4.04 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.219 0.608 . . . . 0.0 111.09 -171.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.5 m -127.14 121.1 30.45 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.81 0.844 . . . . 0.0 110.959 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.45 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 10.8 t -74.66 134.4 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.545 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.2 t70 -76.18 137.72 40.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.869 0.467 . . . . 0.0 109.911 -176.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.28 -39.05 81.71 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.345 0.658 . . . . 0.0 112.104 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.13 -4.51 41.96 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.542 0.737 . . . . 0.0 112.746 -172.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -100.97 -31.76 10.96 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 58' ' ' ASP . 35.4 mt -70.43 111.96 4.8 Favored 'Isoleucine or valine' 0 C--N 1.354 0.781 0 CA-C-O 121.261 0.553 . . . . 0.0 110.568 -176.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 42.2 t -112.27 171.96 7.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.65 1.18 . . . . 0.0 108.414 169.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.1 -30.05 68.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 167.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -71.98 -10.37 59.68 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.055 0.942 . . . . 0.0 111.542 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.446 HG23 HD13 ' A' ' 73' ' ' LEU . 96.3 m -69.25 -33.16 72.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.545 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.8 m-85 -89.36 11.49 18.96 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 69' ' ' THR . 9.8 pt-20 -58.76 -47.42 84.74 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 118.084 0.402 . . . . 0.0 110.792 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' GLU . 62.7 p -140.18 162.63 34.79 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.508 0.723 . . . . 0.0 111.125 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.71 -42.46 93.1 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 124.056 0.943 . . . . 0.0 110.924 176.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.99 -27.4 70.33 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 124.476 1.11 . . . . 0.0 112.616 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.7 m -67.67 -52.46 37.69 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 122.729 0.412 . . . . 0.0 110.754 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.545 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -60.81 -38.24 84.72 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 117.788 0.267 . . . . 0.0 110.769 176.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.01 63.11 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 124.344 1.027 . . . . 0.0 110.049 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.25 -44.91 92.36 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 123.967 0.792 . . . . 0.0 110.483 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.506 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 6.5 m-85 -58.62 -55.83 30.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.207 0.603 . . . . 0.0 111.512 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.8 m -66.67 -27.36 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.412 0.285 . . . . 0.0 111.39 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.57 -28.26 63.72 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.051 0.54 . . . . 0.0 111.036 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 63.2 m170 -73.45 -38.16 65.57 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.753 0.421 . . . . 0.0 110.169 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -69.54 -54.07 15.93 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.887 0.875 . . . . 0.0 112.238 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.68 -14.47 60.35 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.958 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 51.5 m -95.61 -33.12 12.49 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 118.078 0.399 . . . . 0.0 110.559 174.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 57.6 m80 . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 124.02 0.928 . . . . 0.0 109.246 -176.936 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.659 H281 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.433 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -36.91 9.98 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.356 0.662 . . . . 0.0 110.869 177.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -77.89 -14.2 59.63 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-O 118.541 -0.742 . . . . 0.0 112.948 -167.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -51.89 -34.0 39.32 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 123.439 0.695 . . . . 0.0 112.068 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.49 -49.83 69.83 Favored 'General case' 0 C--N 1.352 0.715 0 C-N-CA 124.196 0.998 . . . . 0.0 110.671 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.64 -25.2 60.17 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.501 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.3 t -69.15 -48.83 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.634 0.373 . . . . 0.0 110.051 176.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.453 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 38.9 ptt180 -69.82 -25.58 63.83 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.52 0.328 . . . . 0.0 110.305 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -65.19 -47.42 77.01 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 123.577 0.548 . . . . 0.0 109.625 173.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.423 HG23 HD22 ' A' ' 49' ' ' LEU . 75.3 mt -61.22 -57.75 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.75 0.82 . . . . 0.0 111.428 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.527 HD21 HD12 ' A' ' 30' ' ' LEU . 9.9 mp -66.26 -29.61 69.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.626 0.37 . . . . 0.0 110.59 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' HA2' HD21 ' A' ' 17' ' ' LEU . . . -66.7 -29.07 74.15 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 119.912 -0.382 . . . . 0.0 113.003 172.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.18 -48.63 17.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.44 0.696 . . . . 0.0 110.557 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.6 t -66.58 -56.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.526 0.731 . . . . 0.0 110.293 -174.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.563 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -84.54 -2.37 57.24 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.95 0.5 . . . . 0.0 110.982 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 58.0 t30 60.77 50.88 5.13 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.636 1.174 . . . . 0.0 111.533 170.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.491 HD21 ' HA2' ' A' ' 12' ' ' GLY . 2.7 mm? -72.69 -34.05 66.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.943 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.67 -90.7 0.25 Allowed Glycine 0 C--N 1.348 1.223 0 O-C-N 123.486 0.491 . . . . 0.0 112.772 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -94.01 -23.16 18.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.622 0.769 . . . . 0.0 111.012 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -68.32 -29.13 67.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.453 ' O ' ' HD2' ' A' ' 8' ' ' ARG . 9.5 pttm -69.89 -29.89 67.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.453 0.301 . . . . 0.0 111.017 173.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -75.52 -35.49 60.73 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.181 0.592 . . . . 0.0 110.775 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.4 HG23 ' HA ' ' A' ' 20' ' ' ARG . 11.2 t -83.49 -22.33 32.55 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.938 0.495 . . . . 0.0 111.67 -174.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -82.45 143.77 30.92 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.4 p -118.98 -174.47 2.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.765 1.226 . . . . 0.0 110.225 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.41 88.8 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.292 0.567 . . . . 0.0 111.213 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 m -84.57 3.85 34.84 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.859 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.0 t -95.31 151.31 19.37 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.676 0.79 . . . . 0.0 110.16 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -87.14 148.79 4.38 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.162 1.385 . . . . 0.0 110.183 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.527 HD12 HD21 ' A' ' 11' ' ' LEU . 70.3 mt -114.72 -68.46 0.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.278 0.631 . . . . 0.0 109.737 175.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.66 112.54 2.29 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.518 0.727 . . . . 0.0 109.256 176.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.37 -40.38 2.5 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 123.615 0.572 . . . . 0.0 112.292 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -83.12 -34.64 26.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.382 0.673 . . . . 0.0 110.835 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.442 HG23 HD13 ' A' ' 17' ' ' LEU . 34.7 mm -87.97 117.16 68.13 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 173.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.27 0.27 10.16 Favored 'Trans proline' 0 C--N 1.369 1.623 0 C-N-CA 122.711 2.274 . . . . 0.0 112.562 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 10.9 mm-40 -95.08 -18.03 21.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.909 0.884 . . . . 0.0 109.947 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -81.45 92.54 6.47 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -107.12 -164.75 1.01 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.192 0.997 . . . . 0.0 111.068 176.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.562 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.0 t -49.6 -69.3 0.12 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.294 1.838 . . . . 0.0 112.953 176.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.8 mmm -68.84 -19.06 64.25 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.895 -0.503 . . . . 0.0 111.233 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.563 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -65.82 -43.3 89.0 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-O 118.706 -0.664 . . . . 0.0 111.538 174.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' ' 39' ' ' SER . 4.5 m -61.43 -38.22 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.425 HG23 H312 ' A' ' 84' ' ' PNS . 7.4 t -66.38 -47.33 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.964 -176.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -61.51 -40.47 94.72 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.017 -1.447 . . . . 0.0 112.445 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.406 ' O ' HD21 ' A' ' 49' ' ' LEU . 31.0 m -77.38 -31.22 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.13 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.526 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.8 mt -61.76 -54.05 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.454 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 71.7 m -58.62 -39.5 80.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 124.807 1.317 . . . . 0.0 111.357 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -48.1 83.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.601 0.76 . . . . 0.0 111.195 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.423 HD22 HG23 ' A' ' 10' ' ' ILE . 3.8 mm? -53.73 -46.32 70.81 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.432 0.693 . . . . 0.0 110.496 174.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.2 mm-40 -55.03 -46.82 75.31 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 124.172 0.92 . . . . 0.0 111.016 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 47' ' ' THR . 16.0 mm-40 -70.5 -52.16 23.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.109 -174.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -68.93 -35.03 76.33 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -97.48 -6.58 33.44 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 64.34 36.9 8.8 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.329 1.052 . . . . 0.0 112.076 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -132.83 -175.48 3.79 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.711 0.404 . . . . 0.0 110.642 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.76 127.64 33.2 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 122.626 0.37 . . . . 0.0 110.917 172.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.22 129.9 36.68 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' HG13 ' A' ' 62' ' ' ILE . 21.5 t70 -77.16 148.52 35.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.101 0.56 . . . . 0.0 110.37 -175.044 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.48 -43.21 71.53 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.137 0.975 . . . . 0.0 112.288 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.87 -12.06 61.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.838 0.855 . . . . 0.0 113.015 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -107.47 -15.74 14.54 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 117.918 0.326 . . . . 0.0 110.909 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 58' ' ' ASP . 52.3 mt -74.98 106.53 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 173.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.8 t -126.48 171.28 11.18 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.634 1.173 . . . . 0.0 109.346 173.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -70.08 -26.7 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 121.137 0.494 . . . . 0.0 109.95 168.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -70.37 -10.7 59.77 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.053 0.941 . . . . 0.0 111.488 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.46 HG23 HD13 ' A' ' 73' ' ' LEU . 56.1 m -72.46 -38.1 68.33 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.907 0.483 . . . . 0.0 109.802 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.526 ' HA ' HD21 ' A' ' 73' ' ' LEU . 74.6 m-85 -99.11 9.24 43.88 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -175.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.18 -44.86 96.63 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.246 0.341 . . . . 0.0 110.921 -176.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 49.6 p -137.28 159.6 41.45 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.923 0.889 . . . . 0.0 110.225 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.96 -34.17 72.91 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 123.871 0.732 . . . . 0.0 111.127 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.27 -40.39 98.53 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 124.518 1.136 . . . . 0.0 112.194 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.41 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 38.9 m -60.84 -50.74 72.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.32 0.648 . . . . 0.0 110.845 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.526 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -58.0 -45.24 87.14 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 123.257 0.348 . . . . 0.0 110.492 176.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.599 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.49 -44.1 80.32 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 124.667 1.229 . . . . 0.0 110.392 -179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.2 -52.0 64.74 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.422 1.076 . . . . 0.0 110.277 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.464 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 31.6 m-85 -54.91 -58.97 5.46 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.118 0.886 . . . . 0.0 110.966 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 73' ' ' LEU . 29.5 m -66.4 -24.08 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.416 0.686 . . . . 0.0 112.791 -176.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 63.3 mm-40 -59.97 -52.13 66.73 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 169.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -65.5 -41.61 93.03 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.012 -172.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 27.7 mmmt -73.63 -43.93 58.29 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 123.762 0.663 . . . . 0.0 111.741 -172.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.87 -17.01 56.31 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 122.673 0.389 . . . . 0.0 111.548 -177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 62.2 m -88.63 -44.56 10.53 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.975 0.417 . . . . 0.0 111.285 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 69.1 m80 . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.232 -171.75 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.475 H421 HD13 ' A' ' 46' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -36.43 9.92 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.39 1.076 . . . . 0.0 110.739 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -75.74 -12.25 60.15 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.05 0.94 . . . . 0.0 112.941 -168.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -54.91 -30.93 59.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.844 0.715 . . . . 0.0 111.872 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.44 -44.76 70.63 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.885 0.874 . . . . 0.0 110.709 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.423 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.09 -32.06 69.94 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 177.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.69 -47.58 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 122.963 0.505 . . . . 0.0 109.93 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.52 ' HA ' HD13 ' A' ' 11' ' ' LEU . 31.4 ptt180 -68.08 -29.94 69.01 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.383 0.427 . . . . 0.0 109.999 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.569 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.4 t30 -60.89 -46.31 91.15 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.473 0.709 . . . . 0.0 110.025 174.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.47 HG23 HD21 ' A' ' 49' ' ' LEU . 86.1 mt -60.83 -44.8 98.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.418 176.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.52 HD13 ' HA ' ' A' ' 8' ' ' ARG . 39.9 mt -62.14 -38.17 87.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.061 0.544 . . . . 0.0 111.066 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.565 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -73.34 -25.91 71.68 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.145 -0.48 . . . . 0.0 113.481 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.35 -51.3 17.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.649 0.78 . . . . 0.0 110.554 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.7 t -77.18 -55.32 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.669 -173.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.453 HD12 HD11 ' A' ' 37' ' ' LEU . 33.7 mt -84.02 -4.12 58.51 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.966 -171.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 68.16 44.46 1.41 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 124.694 1.197 . . . . 0.0 111.474 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.565 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 9.9 mp -73.61 -36.31 65.47 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.298 174.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 65.6 -87.1 0.09 OUTLIER Glycine 0 C--N 1.354 1.549 0 O-C-N 123.829 0.706 . . . . 0.0 112.659 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.23 -28.14 19.05 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.52 0.728 . . . . 0.0 111.123 177.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.481 HH11 HD22 ' A' ' 24' ' ' LEU . 2.0 tmt_? -67.31 -22.92 65.61 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.937 0.895 . . . . 0.0 110.411 -173.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.3 pttt -67.25 -29.29 68.88 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.028 0.531 . . . . 0.0 111.139 176.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -95.09 -18.96 20.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.452 0.701 . . . . 0.0 110.658 -173.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.413 HG23 ' O ' ' A' ' 20' ' ' ARG . 5.9 t -81.43 -10.98 59.4 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.732 0.413 . . . . 0.0 111.121 176.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.481 HD22 HH11 ' A' ' 20' ' ' ARG . 4.1 pp -102.66 152.8 20.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.813 0.445 . . . . 0.0 110.571 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.7 p -122.97 -171.63 2.33 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.485 1.114 . . . . 0.0 110.095 -174.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.73 67.57 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.308 0.643 . . . . 0.0 112.357 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.1 m -74.86 -26.71 59.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.614 0.766 . . . . 0.0 112.171 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 86.5 p -63.28 131.48 48.49 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 122.938 0.495 . . . . 0.0 111.34 -172.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.03 149.17 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.488 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.2 mt -111.17 -67.9 0.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.6 mt -57.92 112.13 1.39 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.601 0.36 . . . . 0.0 110.328 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 99.1 -28.93 13.01 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 115.426 -0.806 . . . . 0.0 113.569 177.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -88.62 -47.48 8.25 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 117.254 0.527 . . . . 0.0 110.63 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.488 HG12 ' HA ' ' A' ' 30' ' ' LEU . 27.9 mm -76.25 115.74 49.78 Favored Pre-proline 0 N--CA 1.472 0.64 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 177.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.91 -5.14 16.43 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 122.381 2.054 . . . . 0.0 112.856 -174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -107.13 -0.24 22.95 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.461 0.704 . . . . 0.0 110.911 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.453 HD11 HD12 ' A' ' 15' ' ' LEU . 39.1 tp -94.74 80.29 3.76 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.466 0.65 . . . . 0.0 109.529 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.401 ' O ' HG11 ' A' ' 42' ' ' VAL . 3.8 p30 -95.97 -165.88 1.35 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.273 1.029 . . . . 0.0 110.275 176.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.555 ' O ' HG21 ' A' ' 42' ' ' VAL . 35.5 t -52.98 -69.58 0.11 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 125.391 1.476 . . . . 0.0 113.05 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 15.5 mmt -66.0 -23.84 66.65 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.793 -0.567 . . . . 0.0 111.388 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.63 83.6 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 175.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.555 HG21 ' O ' ' A' ' 39' ' ' SER . 15.1 m -66.99 -35.75 75.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.549 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.439 HG21 H313 ' A' ' 84' ' ' PNS . 7.2 t -65.0 -41.42 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 121.503 0.668 . . . . 0.0 110.701 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -61.93 -46.96 87.04 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 114.445 -1.252 . . . . 0.0 112.089 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.1 m -70.16 -28.99 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 CA-C-O 119.194 -0.431 . . . . 0.0 111.669 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 84.2 mt -59.0 -55.51 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.408 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 52.3 m -57.62 -42.46 83.34 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.918 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -38.77 90.89 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.941 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.47 HD21 HG23 ' A' ' 10' ' ' ILE . 2.4 mm? -56.98 -48.51 78.24 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.8 mm-40 -52.09 -50.91 60.69 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.491 1.119 . . . . 0.0 110.656 177.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 47' ' ' THR . 61.8 mm-40 -63.66 -58.12 7.91 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.642 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -69.47 -35.54 75.7 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -170.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -89.89 -13.6 36.02 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.13 49.18 2.74 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.088 0.955 . . . . 0.0 111.357 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -143.49 -169.48 3.07 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.087 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.0 t -138.01 131.26 30.45 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.959 0.503 . . . . 0.0 110.664 172.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.0 t -90.89 129.97 40.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 168.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.445 ' O ' HG13 ' A' ' 62' ' ' ILE . 36.2 t70 -74.79 148.39 40.39 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -65.84 -28.41 68.96 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.606 0.363 . . . . 0.0 111.789 -174.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.08 -29.25 66.2 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.71 0.804 . . . . 0.0 111.109 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -94.14 -13.48 26.69 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 122.623 0.369 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 58' ' ' ASP . 61.7 mt -75.7 107.82 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 172.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.5 t -115.7 167.31 11.03 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.933 0.893 . . . . 0.0 109.636 173.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.438 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -65.24 -31.83 73.18 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 165.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -71.26 -10.98 60.65 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.449 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.472 HG23 HD13 ' A' ' 73' ' ' LEU . 41.1 m -79.21 -41.38 28.44 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.52 ' HA ' HD23 ' A' ' 73' ' ' LEU . 43.2 m-85 -99.0 11.95 37.44 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.711 0.804 . . . . 0.0 113.048 -174.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.542 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.4 pt-20 -61.22 -44.62 96.98 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.294 0.638 . . . . 0.0 111.749 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.542 HG22 ' HG3' ' A' ' 68' ' ' GLU . 8.0 t -148.0 158.68 44.18 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 110.229 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.37 -35.89 70.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.572 0.749 . . . . 0.0 111.434 -178.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.87 -42.07 96.47 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.492 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -63.95 -47.31 80.96 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.295 0.638 . . . . 0.0 111.44 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.52 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -57.53 -45.03 85.5 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.563 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.49 -44.79 89.54 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.835 1.334 . . . . 0.0 110.899 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -58.73 -51.12 71.33 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 123.972 0.795 . . . . 0.0 110.645 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.503 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 22.7 m-85 -56.08 -55.34 34.17 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.74 -24.97 31.6 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 123.055 0.542 . . . . 0.0 111.774 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.3 mm-40 -56.49 -56.88 15.71 Favored 'General case' 0 C--N 1.365 1.248 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -59.85 -46.35 89.55 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.196 0.935 . . . . 0.0 111.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.7 mmmt -57.97 -55.81 30.1 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.365 1.066 . . . . 0.0 112.034 -176.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.29 -13.71 59.73 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.876 -175.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.1 m -78.47 -20.52 50.73 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 117.953 0.342 . . . . 0.0 111.445 173.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.313 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.451 H431 ' HB ' ' A' ' 42' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.586 ' HE2' HD22 ' A' ' 75' ' ' LEU . 1.9 tpt . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.99 -36.74 65.73 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -163.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG21 ' A' ' 7' ' ' VAL . 11.0 m-70 -73.5 -9.31 58.56 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.412 -173.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.7 -32.62 59.75 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.133 0.573 . . . . 0.0 110.166 173.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.56 -52.03 43.54 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.466 -176.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.461 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.32 -35.01 75.51 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.14 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 3' ' ' HIS . 97.5 t -66.18 -47.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 122.585 0.354 . . . . 0.0 110.361 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.463 ' HA ' HD13 ' A' ' 11' ' ' LEU . 36.2 ptt180 -69.88 -27.18 64.6 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.646 0.378 . . . . 0.0 110.431 -178.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -61.63 -45.66 93.12 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.222 173.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 6' ' ' ALA . 92.8 mt -64.09 -46.33 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.58 1.152 . . . . 0.0 111.508 177.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.463 HD13 ' HA ' ' A' ' 8' ' ' ARG . 52.1 mt -61.58 -43.03 99.61 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.321 0.648 . . . . 0.0 110.966 -177.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.11 -19.14 77.66 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.056 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -75.09 -42.18 57.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 110.232 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 79.9 t -83.14 -46.23 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.26 -172.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.43 HD11 ' HB2' ' A' ' 41' ' ' ALA . 1.8 mm? -99.02 1.07 45.06 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.896 0.478 . . . . 0.0 111.991 -177.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.7 t30 60.05 63.19 1.48 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.86 1.264 . . . . 0.0 111.367 173.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.476 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 10.0 mp -81.49 -29.67 33.58 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.764 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.77 -105.94 1.85 Allowed Glycine 0 C--N 1.348 1.215 0 O-C-N 123.555 0.535 . . . . 0.0 112.35 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.6 -24.23 36.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.261 0.624 . . . . 0.0 110.443 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.552 HH11 HD22 ' A' ' 24' ' ' LEU . 2.3 tmt_? -64.78 -35.4 80.98 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.654 0.781 . . . . 0.0 109.66 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 52.6 pttt -67.08 -23.34 65.84 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.525 0.515 . . . . 0.0 111.549 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -94.59 -42.72 8.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 122.634 0.374 . . . . 0.0 110.724 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.51 HG22 ' HA ' ' A' ' 20' ' ' ARG . 14.5 t -75.51 3.96 8.38 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.489 0.716 . . . . 0.0 112.43 -172.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.552 HD22 HH11 ' A' ' 20' ' ' ARG . 3.1 pp -95.97 -179.79 4.81 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.758 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 45.3 p -133.12 -171.94 2.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.564 1.146 . . . . 0.0 109.124 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.1 66.3 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.45 0.7 . . . . 0.0 111.728 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.5 m -75.61 -5.42 45.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.984 0.914 . . . . 0.0 111.997 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 29.2 t -71.0 130.47 41.66 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.928 0.491 . . . . 0.0 110.674 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.0 t -87.13 138.43 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.45 ' HA ' HG12 ' A' ' 34' ' ' ILE . 59.6 mt -105.62 -71.58 0.74 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.892 0.477 . . . . 0.0 111.304 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.4 HD22 HD22 ' A' ' 37' ' ' LEU . 71.1 mt -53.96 118.98 4.43 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 123.705 0.628 . . . . 0.0 111.02 177.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.43 -41.65 3.1 Favored Glycine 0 C--N 1.342 0.869 0 O-C-N 123.967 0.792 . . . . 0.0 113.401 177.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -72.14 -48.63 42.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.655 0.782 . . . . 0.0 111.19 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.45 HG12 ' HA ' ' A' ' 30' ' ' LEU . 35.3 mm -73.69 116.99 57.21 Favored Pre-proline 0 CA--C 1.545 0.758 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -74.15 -0.24 9.33 Favored 'Trans proline' 0 C--N 1.369 1.653 0 C-N-CA 122.8 2.333 . . . . 0.0 113.224 -175.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -107.93 -2.4 19.81 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.915 0.886 . . . . 0.0 110.525 178.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.4 HD22 HD22 ' A' ' 31' ' ' LEU . 3.7 tt -106.19 102.59 11.99 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -175.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -112.48 -164.53 0.92 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.487 1.115 . . . . 0.0 110.583 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.53 ' O ' HG23 ' A' ' 42' ' ' VAL . 45.0 t -45.38 -67.67 0.26 Allowed 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 126.668 1.987 . . . . 0.0 113.231 171.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 22.3 mmt -62.48 -25.97 68.28 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.032 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.43 ' HB2' HD11 ' A' ' 15' ' ' LEU . . . -64.99 -38.69 91.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 118.874 -0.584 . . . . 0.0 112.276 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 39' ' ' SER . 2.5 m -61.11 -38.45 79.66 Favored 'Isoleucine or valine' 0 C--N 1.368 1.406 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 176.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.487 HG22 H312 ' A' ' 84' ' ' PNS . 10.6 t -69.58 -45.43 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.771 -177.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -57.59 -42.72 83.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.124 -1.398 . . . . 0.0 112.077 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.2 m -78.91 -28.03 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.492 -0.766 . . . . 0.0 112.175 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.489 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.6 mt -59.83 -55.59 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 171.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 30.1 m -54.52 -48.7 71.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.921 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.07 99.12 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.057 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -54.87 -51.66 65.25 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.283 0.633 . . . . 0.0 109.831 175.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.8 mm-40 -54.01 -44.2 70.7 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.471 1.108 . . . . 0.0 111.181 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 47' ' ' THR . 13.1 mm-40 -63.25 -64.15 0.99 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.71 -179.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -61.98 -41.43 98.01 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.703 0.801 . . . . 0.0 113.049 -170.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -88.0 -21.32 24.89 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 118.962 -0.542 . . . . 0.0 112.016 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 63.88 58.95 1.17 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.18 0.992 . . . . 0.0 111.113 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -147.38 -177.19 5.56 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.003 -0.998 . . . . 0.0 109.749 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.2 t -131.1 117.9 19.77 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.531 0.333 . . . . 0.0 111.014 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.6 t -76.8 124.89 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 168.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 34.1 t70 -65.6 135.92 55.68 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.597 0.359 . . . . 0.0 110.315 -176.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -60.83 -27.58 68.18 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.243 0.617 . . . . 0.0 112.037 -173.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -82.07 -19.0 41.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.302 0.641 . . . . 0.0 112.272 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -92.29 -19.67 21.91 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 176.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 58' ' ' ASP . 57.7 mt -72.84 113.51 10.58 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.2 t -129.5 175.62 8.64 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 125.066 1.346 . . . . 0.0 108.389 175.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.45 -30.24 70.55 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 168.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -72.57 -13.6 61.43 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.603 0.761 . . . . 0.0 111.758 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 49.5 m -78.31 -32.42 49.27 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.054 0.542 . . . . 0.0 109.625 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.455 ' HA ' HD22 ' A' ' 73' ' ' LEU . 59.1 m-85 -108.94 7.16 25.83 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.633 0.773 . . . . 0.0 112.998 -177.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.96 -40.53 95.14 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 117.655 0.207 . . . . 0.0 111.043 -176.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.7 p -135.65 163.86 29.18 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.727 0.811 . . . . 0.0 110.241 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.48 -35.83 78.76 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.582 173.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.42 -30.99 75.79 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.026 0.829 . . . . 0.0 112.68 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.4 m -67.92 -51.73 44.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.353 0.661 . . . . 0.0 110.458 176.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.455 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.92 -46.99 86.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 122.915 0.134 . . . . 0.0 110.864 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -52.74 -50.39 63.55 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.596 1.185 . . . . 0.0 109.742 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.586 HD22 ' HE2' ' A' ' 1' ' ' MET . 0.2 OUTLIER -54.32 -56.48 18.09 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.582 1.153 . . . . 0.0 110.426 -179.007 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.4 m-85 -57.21 -54.76 43.08 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.95 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 17.2 m -67.79 -25.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.048 0.539 . . . . 0.0 111.616 -176.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.517 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 69.1 mm-40 -60.56 -46.65 89.42 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 171.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -59.03 -50.74 72.94 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 123.518 0.511 . . . . 0.0 110.665 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -63.48 -50.99 67.5 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.715 -170.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.12 -13.93 60.9 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.155 0.582 . . . . 0.0 112.157 -177.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.3 m -89.63 -1.37 58.0 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.69 0.396 . . . . 0.0 111.553 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 . . . . . 0 N--CA 1.48 1.027 0 C-N-CA 123.831 0.852 . . . . 0.0 109.145 175.367 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.487 H312 HG22 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.22 0.533 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.24 -34.48 10.32 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.096 0.959 . . . . 0.0 110.394 170.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.4 ' O ' HG22 ' A' ' 7' ' ' VAL . 15.7 m-70 -75.06 -20.05 59.72 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -53.71 -28.95 36.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 123.57 0.543 . . . . 0.0 111.898 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -65.26 -48.38 73.41 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 123.514 0.726 . . . . 0.0 111.083 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.13 -30.81 62.48 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.169 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 3' ' ' HIS . 91.7 t -65.08 -46.6 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 39.6 ptt180 -74.56 -24.89 59.0 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.988 0.515 . . . . 0.0 110.641 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.453 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 48.7 t30 -61.45 -47.04 87.55 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 172.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 93.6 mt -62.35 -45.66 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.955 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.41 -42.9 98.76 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.797 0.439 . . . . 0.0 110.961 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.496 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -70.58 -18.93 76.01 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.206 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -81.85 -52.49 7.05 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.053 0.541 . . . . 0.0 111.161 174.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.9 t -68.05 -57.99 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.321 0.648 . . . . 0.0 109.84 -175.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 41' ' ' ALA . 2.0 mm? -81.21 -10.93 59.53 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 123.649 0.593 . . . . 0.0 111.272 -176.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 66.65 47.94 1.51 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.454 1.102 . . . . 0.0 110.868 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.411 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 3.5 mm? -66.53 -34.38 77.79 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 171.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.95 -93.27 0.15 Allowed Glycine 0 C--N 1.355 1.588 0 O-C-N 123.938 0.774 . . . . 0.0 112.988 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -79.19 -34.52 42.95 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.353 1.061 . . . . 0.0 110.413 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HA ' HG21 ' A' ' 23' ' ' THR . 1.7 tmt_? -68.58 -25.34 64.84 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.577 -171.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.496 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 56.1 pttt -64.98 -29.06 69.96 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.476 0.179 . . . . 0.0 111.33 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -85.53 -29.9 23.84 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 122.864 0.465 . . . . 0.0 110.982 -175.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.455 HG21 ' HA ' ' A' ' 20' ' ' ARG . 12.1 t -84.37 -9.86 58.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.045 0.538 . . . . 0.0 111.819 -176.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 pp -94.22 151.79 19.19 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 177.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.0 p -112.67 -173.54 2.27 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.809 0.844 . . . . 0.0 109.938 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 -23.62 66.11 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.042 0.537 . . . . 0.0 111.332 172.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.3 m -81.16 0.98 33.93 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.26 1.024 . . . . 0.0 112.734 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.7 t -81.94 137.7 35.12 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.653 0.381 . . . . 0.0 110.651 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -86.91 145.76 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 124.331 1.052 . . . . 0.0 109.188 175.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.4 mt -108.18 -70.68 0.79 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.233 0.613 . . . . 0.0 110.676 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.461 HD22 HD12 ' A' ' 37' ' ' LEU . 21.4 mt -51.3 113.99 1.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.243 1.017 . . . . 0.0 112.269 178.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.49 -27.93 4.03 Favored Glycine 0 C--N 1.348 1.202 0 O-C-N 123.942 0.777 . . . . 0.0 114.059 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -76.7 -59.74 2.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.319 0.648 . . . . 0.0 109.915 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.421 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 43.9 mm -70.84 121.98 85.49 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 173.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -69.37 -9.22 25.67 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 122.653 2.235 . . . . 0.0 112.452 -175.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 16.6 mm-40 -94.48 -21.87 18.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.831 0.853 . . . . 0.0 110.528 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -82.45 80.77 8.52 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -174.191 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -112.55 -168.45 1.32 Allowed 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 125.204 1.402 . . . . 0.0 109.516 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.538 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.2 t -51.06 -70.42 0.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 125.751 1.621 . . . . 0.0 114.486 -173.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.8 mmm -65.0 -22.06 66.94 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.632 -0.667 . . . . 0.0 111.251 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.493 ' HB2' HD13 ' A' ' 15' ' ' LEU . . . -67.07 -35.96 80.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.481 0.713 . . . . 0.0 111.932 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -64.54 -37.9 81.24 Favored 'Isoleucine or valine' 0 C--N 1.372 1.545 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.474 HG23 H311 ' A' ' 84' ' ' PNS . 19.1 t -67.66 -44.33 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.684 -179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -61.7 -38.85 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.132 -1.394 . . . . 0.0 112.532 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.409 ' O ' HD21 ' A' ' 49' ' ' LEU . 30.1 m -80.1 -29.15 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.097 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.543 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -59.8 -57.06 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 171.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.9 m -55.72 -44.39 77.43 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.624 1.202 . . . . 0.0 111.37 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.49 -47.79 84.13 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.003 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.409 HD21 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -52.17 -49.75 63.18 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.424 0.69 . . . . 0.0 110.174 174.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.9 mm-40 -57.47 -43.25 83.89 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.994 0.918 . . . . 0.0 111.368 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -67.08 -52.45 41.93 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.785 0.834 . . . . 0.0 112.59 -176.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -69.57 -39.35 77.42 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -91.03 -16.8 27.32 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 57.97 64.27 1.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 124.611 1.164 . . . . 0.0 111.11 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -149.24 -176.36 5.34 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.679 0.792 . . . . 0.0 109.622 178.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -134.89 116.73 15.08 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 122.357 0.263 . . . . 0.0 111.421 171.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.557 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.8 t -69.34 127.85 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 168.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.459 ' O ' HG13 ' A' ' 62' ' ' ILE . 32.0 t70 -72.41 142.86 48.68 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 118.142 0.428 . . . . 0.0 110.767 -173.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -50.3 -44.65 54.1 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.521 1.128 . . . . 0.0 112.592 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.7 -21.76 64.39 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.107 -174.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -97.98 -20.97 17.09 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.157 0.183 . . . . 0.0 110.909 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 58' ' ' ASP . 60.9 mt -75.47 117.48 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 0.0 110.264 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 t -144.37 179.59 7.15 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 124.117 0.967 . . . . 0.0 109.491 174.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.421 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -60.22 -34.7 74.02 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.71 0.804 . . . . 0.0 110.151 167.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -67.84 -17.15 64.41 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -81.11 -37.82 28.27 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.453 0.701 . . . . 0.0 110.024 174.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.467 ' HA ' HD23 ' A' ' 73' ' ' LEU . 39.2 m-85 -104.85 14.7 29.11 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.28 0.632 . . . . 0.0 112.402 -176.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.54 -46.14 89.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.65 0.38 . . . . 0.0 110.605 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.3 p -137.28 158.41 44.49 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.638 0.775 . . . . 0.0 110.43 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.3 tp -55.41 -39.72 70.56 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.504 0.722 . . . . 0.0 110.71 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.46 95.76 Favored Glycine 0 C--N 1.347 1.176 0 O-C-N 124.452 1.095 . . . . 0.0 112.474 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -60.09 -45.31 93.38 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 122.787 0.435 . . . . 0.0 110.978 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.86 -42.18 99.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 122.999 0.187 . . . . 0.0 110.759 175.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.553 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.16 -49.03 79.42 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 124.153 0.908 . . . . 0.0 111.03 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.84 -43.74 92.07 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.634 0.774 . . . . 0.0 110.696 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.508 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 7.1 m-85 -58.08 -52.0 67.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 119.235 -0.412 . . . . 0.0 110.587 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.3 m -70.88 -24.73 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.003 0.521 . . . . 0.0 111.975 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 78.6 mm-40 -56.71 -44.85 81.99 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 168.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -73.19 -39.42 65.6 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.307 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 57' ' ' VAL . 32.5 mmmt -64.91 -53.0 53.39 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.481 0.712 . . . . 0.0 111.912 -173.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.07 -13.1 60.45 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.436 -177.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.8 m -109.66 20.98 17.51 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.78 0.832 . . . . 0.0 111.845 172.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -172.662 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.474 H311 HG23 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.618 0.247 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -98.02 -37.82 9.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.009 0.923 . . . . 0.0 110.323 172.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -75.14 -12.98 60.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.992 0.917 . . . . 0.0 113.102 -169.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -57.67 -22.13 44.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 123.541 0.526 . . . . 0.0 111.689 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.3 -58.98 6.18 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.265 1.026 . . . . 0.0 110.926 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.66 58.82 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.783 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 87.4 t -63.53 -54.84 27.41 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -69.28 -28.04 65.95 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.289 0.236 . . . . 0.0 110.516 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -60.1 -52.57 64.77 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.319 0.647 . . . . 0.0 109.906 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.402 HG23 HD21 ' A' ' 49' ' ' LEU . 92.6 mt -64.05 -51.9 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.997 -178.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.407 HD12 HD13 ' A' ' 30' ' ' LEU . 76.7 mt -61.05 -39.63 90.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.074 0.55 . . . . 0.0 111.59 -175.036 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.535 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.1 -23.94 70.24 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 121.329 -0.462 . . . . 0.0 113.366 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.34 -27.01 38.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.033 0.533 . . . . 0.0 110.915 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.2 t -86.28 -59.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.336 0.655 . . . . 0.0 109.644 177.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.451 HD13 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -77.38 3.77 12.42 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -174.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 71.5 38.01 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.293 1.037 . . . . 0.0 111.192 167.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.411 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.6 mp -75.78 -32.08 59.77 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.165 172.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.5 -95.9 0.27 Allowed Glycine 0 C--N 1.353 1.51 0 O-C-N 123.556 0.535 . . . . 0.0 113.224 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -90.11 -25.29 20.8 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.025 0.93 . . . . 0.0 110.897 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.436 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.11 -26.82 69.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.574 0.749 . . . . 0.0 111.348 -175.523 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.535 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.8 pttt -66.26 -30.32 70.73 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.041 0.537 . . . . 0.0 111.731 178.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -81.91 -22.3 36.87 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.513 0.725 . . . . 0.0 111.081 -175.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 t -93.49 2.62 56.38 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.836 0.454 . . . . 0.0 112.054 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.436 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -108.06 159.06 16.87 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.951 -0.468 . . . . 0.0 110.743 176.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -116.26 -174.92 2.64 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.663 0.785 . . . . 0.0 110.915 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -67.3 -17.69 64.88 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.28 0.632 . . . . 0.0 111.933 175.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -74.23 -24.03 59.25 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.34 0.656 . . . . 0.0 111.46 173.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.1 t -63.54 125.43 24.22 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.712 0.805 . . . . 0.0 111.455 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.8 t -79.23 147.14 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.407 HD13 HD12 ' A' ' 11' ' ' LEU . 67.5 mt -116.43 -68.14 0.94 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.241 0.616 . . . . 0.0 110.07 -177.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 tt -61.86 111.23 1.8 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.54 -26.95 22.67 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.461 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -88.92 -49.89 6.52 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 117.321 0.56 . . . . 0.0 110.671 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.4 mm -81.35 118.48 72.46 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.93 -6.68 18.4 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.686 2.257 . . . . 0.0 112.848 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -94.24 -18.14 21.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.88 0.872 . . . . 0.0 111.06 -175.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.5 tp -86.66 88.52 7.68 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 122.917 0.487 . . . . 0.0 109.719 -174.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.415 ' H ' ' HB2' ' A' ' 41' ' ' ALA . 13.0 t70 -120.76 -170.68 2.04 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.045 0.938 . . . . 0.0 109.66 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.512 ' O ' HG21 ' A' ' 42' ' ' VAL . 38.1 t -40.27 -69.4 0.13 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 127.615 2.366 . . . . 0.0 114.883 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -66.89 -29.76 69.74 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.211 -0.931 . . . . 0.0 111.761 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.451 ' HB1' HD13 ' A' ' 15' ' ' LEU . . . -66.79 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' ' 39' ' ' SER . 28.6 m -70.42 -33.32 53.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.2 -46.79 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.509 0.671 . . . . 0.0 110.033 175.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -56.68 -48.71 77.04 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.27 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.449 HG21 ' HA ' ' A' ' 42' ' ' VAL . 27.6 m -72.45 -32.9 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.915 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.522 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -60.01 -52.26 63.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.3 m -55.06 -44.61 74.93 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 124.579 1.175 . . . . 0.0 111.177 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -42.35 99.66 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.763 0.825 . . . . 0.0 111.883 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.402 HD21 HG23 ' A' ' 10' ' ' ILE . 3.7 mm? -57.82 -46.29 84.92 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.071 0.548 . . . . 0.0 110.232 173.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.8 mm-40 -54.46 -44.18 72.33 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.232 1.013 . . . . 0.0 110.827 178.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 47' ' ' THR . 43.4 mm-40 -63.01 -57.18 11.56 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.724 -176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -66.35 -44.91 81.93 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.604 0.565 . . . . 0.0 112.258 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -88.56 -9.46 52.21 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 118.941 -0.552 . . . . 0.0 112.359 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 59.47 45.28 13.78 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.271 1.028 . . . . 0.0 111.656 175.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -139.02 -177.02 4.7 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.425 -174.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.7 t -134.49 113.66 12.05 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.2 t -69.06 131.91 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.501 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 16.9 t70 -67.37 134.04 50.73 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.46 0.704 . . . . 0.0 110.158 -176.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -57.98 -38.42 76.05 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.886 0.875 . . . . 0.0 112.949 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -72.35 -20.18 61.51 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.938 0.495 . . . . 0.0 111.995 -176.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 18.3 pt-20 -98.71 -8.92 25.34 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.382 0.273 . . . . 0.0 110.641 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 51.5 mt -87.09 117.81 31.94 Favored 'Isoleucine or valine' 0 C--N 1.359 0.979 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.8 t -155.91 -172.3 4.07 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.308 1.043 . . . . 0.0 108.459 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.85 77.75 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.719 0.408 . . . . 0.0 110.655 176.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.1 mm-40 -68.55 -12.26 61.04 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.149 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.474 HG22 HD12 ' A' ' 73' ' ' LEU . 23.2 m -81.29 -45.14 16.66 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.215 0.606 . . . . 0.0 109.606 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.495 ' HA ' HD21 ' A' ' 73' ' ' LEU . 70.0 m-85 -97.75 6.25 48.14 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -174.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.486 ' HG3' HG23 ' A' ' 69' ' ' THR . 8.7 pt-20 -57.03 -45.13 83.33 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.724 0.64 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.486 HG23 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -146.63 160.21 42.46 Favored 'General case' 0 C--O 1.249 1.058 0 C-N-CA 123.466 0.707 . . . . 0.0 110.036 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 17.3 tp -58.84 -35.66 73.27 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.774 0.83 . . . . 0.0 110.852 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.82 -42.14 96.4 Favored Glycine 0 C--N 1.349 1.276 0 O-C-N 124.635 1.209 . . . . 0.0 112.107 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.5 m -62.58 -49.45 75.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.974 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -57.69 -46.22 84.61 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.137 0.426 . . . . 0.0 110.196 178.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.556 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.46 -39.37 90.65 Favored 'General case' 0 C--O 1.217 -0.65 0 O-C-N 124.529 1.143 . . . . 0.0 111.305 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.78 -49.68 67.47 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.733 0.813 . . . . 0.0 110.621 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 42.4 m-85 -55.72 -49.67 72.42 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.55 0.531 . . . . 0.0 110.32 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.2 m -70.73 -25.66 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -55.69 -48.81 74.48 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -66.9 -41.27 87.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.146 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -63.2 -54.1 42.84 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.65 0.78 . . . . 0.0 112.238 -173.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.44 -13.5 61.08 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.328 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.1 m -97.41 -22.23 16.72 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.422 0.689 . . . . 0.0 111.45 174.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 . . . . . 0 CA--C 1.548 0.901 0 C-N-CA 123.963 0.905 . . . . 0.0 109.385 -174.502 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.61 ' SD ' ' HG3' ' A' ' 78' ' ' GLU . 7.1 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.406 ' N ' HE21 ' A' ' 2' ' ' GLN . 0.0 OUTLIER -98.23 -39.32 8.91 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 0.0 111.724 -175.21 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' HG22 ' A' ' 7' ' ' VAL . 41.7 m-70 -76.8 -10.97 59.75 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.24 -170.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -55.35 -31.88 62.08 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 118.664 0.666 . . . . 0.0 111.799 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.72 -41.54 59.98 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.447 0.699 . . . . 0.0 111.435 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.27 -37.22 83.09 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.959 176.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -67.1 -47.3 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.052 178.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.415 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 28.7 ptt180 -68.65 -25.93 65.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.563 0.345 . . . . 0.0 110.476 -179.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 23.8 t30 -61.86 -50.49 72.02 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.67 0.788 . . . . 0.0 109.531 173.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.549 HG23 HD21 ' A' ' 49' ' ' LEU . 91.5 mt -59.83 -42.72 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.651 1.18 . . . . 0.0 111.281 178.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 46.0 mt -68.96 -41.75 77.54 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.136 0.574 . . . . 0.0 111.056 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.442 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -71.91 -18.27 77.51 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 116.147 -0.478 . . . . 0.0 113.148 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -79.95 -53.75 6.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.848 0.859 . . . . 0.0 110.006 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.49 HG12 ' ND2' ' A' ' 44' ' ' ASN . 79.5 t -73.32 -49.54 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.09 0.956 . . . . 0.0 111.387 -173.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 0.9 OUTLIER -83.93 -3.09 57.69 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.269 0.228 . . . . 0.0 110.84 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 61.64 53.45 3.26 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 124.962 1.305 . . . . 0.0 111.214 172.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.433 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.8 mp -75.81 -28.16 58.22 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.8 171.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.46 -89.03 0.08 OUTLIER Glycine 0 C--N 1.353 1.491 0 O-C-N 124.211 0.944 . . . . 0.0 112.408 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -93.24 -29.34 15.74 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.827 0.851 . . . . 0.0 111.448 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.68 -26.35 66.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.99 0.516 . . . . 0.0 111.355 -170.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 58.1 pttt -58.57 -28.11 65.23 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.701 0.4 . . . . 0.0 111.569 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -79.08 -25.73 43.06 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.81 0.844 . . . . 0.0 110.957 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.1 t -93.81 1.46 56.44 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.614 0.366 . . . . 0.0 111.926 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -109.72 151.46 26.89 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.895 -0.503 . . . . 0.0 110.038 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.8 p -123.51 -171.73 2.37 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.688 0.795 . . . . 0.0 109.996 -175.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.7 -20.3 65.94 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.442 0.697 . . . . 0.0 112.478 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 m -75.89 -21.74 56.83 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.193 0.597 . . . . 0.0 111.859 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -71.55 137.62 48.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.669 0.787 . . . . 0.0 111.422 -175.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.88 160.72 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 C-N-CA 124.573 1.149 . . . . 0.0 109.224 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.6 mt -117.1 -68.51 0.91 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.03 109.31 1.24 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.805 174.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.25 -34.27 5.81 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.273 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -77.27 -57.65 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 12.9 mm -81.73 116.46 63.3 Favored Pre-proline 0 CA--C 1.543 0.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -175.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -77.18 -8.08 17.4 Favored 'Trans proline' 0 C--N 1.369 1.633 0 C-N-CA 122.459 2.106 . . . . 0.0 112.02 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.406 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 6.0 mm-40 -96.48 -6.82 36.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.983 0.913 . . . . 0.0 110.659 -178.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.1 tp -81.72 80.76 7.97 Favored 'General case' 0 C--N 1.349 0.584 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -82.01 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.476 1.511 . . . . 0.0 110.607 -179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.565 ' O ' HG21 ' A' ' 42' ' ' VAL . 48.1 t -43.95 -66.73 0.35 Allowed 'General case' 0 CA--C 1.566 1.577 0 C-N-CA 126.163 1.785 . . . . 0.0 112.469 170.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.409 ' SD ' H311 ' A' ' 84' ' ' PNS . 95.0 mmm -70.56 -15.26 62.75 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.652 -0.655 . . . . 0.0 111.748 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.22 -25.34 51.56 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.319 174.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.565 HG21 ' O ' ' A' ' 39' ' ' SER . 4.7 m -69.61 -37.99 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.12 -42.33 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.648 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.49 ' ND2' HG12 ' A' ' 14' ' ' VAL . 59.6 t30 -68.26 -37.75 81.07 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.553 -176.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.2 m -72.53 -35.71 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.69 177.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.494 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 93.1 mt -59.97 -48.51 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 33.0 m -56.86 -45.06 82.72 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 124.373 1.046 . . . . 0.0 110.732 177.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.26 -41.65 98.63 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.689 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.549 HD21 HG23 ' A' ' 10' ' ' ILE . 3.4 mm? -56.58 -46.68 80.67 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.197 0.599 . . . . 0.0 109.9 176.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.2 mm-40 -51.66 -50.52 60.2 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.266 1.026 . . . . 0.0 110.386 176.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.2 mm-40 -59.81 -63.96 1.11 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.76 -176.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -65.05 -46.02 82.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.651 -169.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -87.67 -7.66 57.13 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.1 t70 65.19 36.41 7.17 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.93 0.892 . . . . 0.0 111.042 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.19 -175.53 3.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.413 0.685 . . . . 0.0 110.118 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -123.14 135.64 54.44 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 37.2 t -84.75 125.19 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 170.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' ILE . 30.2 t70 -75.13 151.33 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.148 0.579 . . . . 0.0 111.083 -174.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -53.45 -41.76 66.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.406 1.082 . . . . 0.0 113.137 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -67.58 -17.96 64.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.836 0.854 . . . . 0.0 111.962 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -115.44 8.01 15.16 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.524 0.729 . . . . 0.0 111.436 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' ASP . 28.9 mt -98.41 105.44 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 77.5 p -146.27 173.23 12.43 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.645 0.778 . . . . 0.0 109.532 171.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.76 71.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 169.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.33 -21.1 66.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.147 0.579 . . . . 0.0 111.469 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.2 m -72.52 -40.31 66.89 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.259 0.624 . . . . 0.0 110.071 175.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.617 ' HA ' HD22 ' A' ' 73' ' ' LEU . 62.3 m-85 -97.43 18.32 15.55 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.634 0.774 . . . . 0.0 113.037 -174.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HG3' HG23 ' A' ' 69' ' ' THR . 9.5 pt-20 -63.58 -46.34 86.29 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.681 0.392 . . . . 0.0 111.629 178.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.52 HG23 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -145.51 155.05 42.85 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 123.354 0.662 . . . . 0.0 110.531 -177.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.56 -32.73 67.41 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.724 0.81 . . . . 0.0 111.296 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.15 -41.68 98.25 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.953 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.2 m -60.4 -52.92 63.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.915 0.486 . . . . 0.0 110.33 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.617 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -61.34 -39.73 91.64 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 123.568 0.542 . . . . 0.0 110.938 -178.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.554 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.08 -49.68 75.1 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.424 1.077 . . . . 0.0 109.988 178.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.14 -39.46 89.86 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.708 0.63 . . . . 0.0 111.702 -177.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.502 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 34.9 m-85 -59.79 -54.75 42.64 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.7 m -67.1 -26.16 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 122.829 0.451 . . . . 0.0 111.787 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.61 ' HG3' ' SD ' ' A' ' 1' ' ' MET . 76.4 mm-40 -57.23 -51.9 67.49 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 170.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 47.9 m170 -63.01 -49.38 74.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.134 -175.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.1 mmmt -60.54 -55.15 36.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.784 0.834 . . . . 0.0 112.04 -172.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.59 -14.32 61.59 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.871 -176.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.4 m -89.52 -28.36 19.68 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.963 0.505 . . . . 0.0 111.442 173.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.6 m170 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.921 -0.562 . . . . 0.0 109.838 177.883 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.409 H311 ' SD ' ' A' ' 40' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.495 ' HG2' ' HB1' ' A' ' 74' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -96.88 -44.28 7.11 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 118.446 0.566 . . . . 0.0 112.067 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.416 ' O ' HG22 ' A' ' 7' ' ' VAL . 82.6 m-70 -75.11 -12.86 60.4 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.939 -169.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.29 -31.2 63.43 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 118.216 0.462 . . . . 0.0 111.4 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -66.53 -52.88 41.0 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 125.006 1.322 . . . . 0.0 110.628 -178.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.489 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.1 -32.25 71.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.506 -178.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.416 HG22 ' O ' ' A' ' 3' ' ' HIS . 86.5 t -68.43 -48.67 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.742 0.417 . . . . 0.0 110.354 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.426 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 40.7 ptt180 -67.55 -30.11 69.67 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.453 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 37.4 t30 -62.24 -46.64 87.92 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.531 0.733 . . . . 0.0 109.914 176.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 6' ' ' ALA . 69.8 mt -61.71 -56.38 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 O-C-N 124.366 1.041 . . . . 0.0 111.672 179.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.531 HD21 HD11 ' A' ' 30' ' ' LEU . 9.7 mp -64.83 -34.03 77.4 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.922 0.139 . . . . 0.0 111.351 -176.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.51 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.79 -18.22 79.1 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 119.813 -0.437 . . . . 0.0 113.309 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.28 -53.04 7.34 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.742 0.417 . . . . 0.0 110.289 174.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.73 -58.57 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.325 1.05 . . . . 0.0 109.829 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.516 HD11 HD23 ' A' ' 37' ' ' LEU . 64.0 mt -77.15 -8.21 57.14 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.135 -175.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.57 62.94 1.05 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.475 1.11 . . . . 0.0 110.717 172.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.566 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 4.1 mm? -85.27 -27.96 25.64 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.587 170.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 69.1 -107.5 2.12 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.873 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.33 -26.22 51.88 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.632 0.773 . . . . 0.0 111.147 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.566 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.68 -32.93 74.09 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.879 0.872 . . . . 0.0 110.068 -172.172 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.51 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.5 pttt -64.37 -34.83 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.95 -177.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -89.49 -21.19 23.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.218 0.207 . . . . 0.0 110.499 -173.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.417 HG23 ' HA ' ' A' ' 20' ' ' ARG . 6.8 t -91.96 7.14 43.51 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.027 0.531 . . . . 0.0 110.94 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -109.0 156.15 20.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.893 0.477 . . . . 0.0 109.77 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 p -111.88 -178.26 3.39 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.248 1.019 . . . . 0.0 110.709 -175.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.49 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -66.53 -27.66 67.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.363 0.665 . . . . 0.0 111.315 177.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.4 p -78.32 -4.04 46.06 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.65 0.78 . . . . 0.0 112.419 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.9 t -80.6 141.01 35.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.137 0.575 . . . . 0.0 110.198 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.3 t -80.65 151.63 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.437 1.095 . . . . 0.0 109.026 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.531 HD11 HD21 ' A' ' 11' ' ' LEU . 82.5 mt -118.58 -69.74 0.83 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.131 0.572 . . . . 0.0 109.929 177.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.8 122.46 18.17 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 175.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.48 -34.78 5.04 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.006 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -86.32 -67.49 0.81 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.195 0.598 . . . . 0.0 111.014 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.2 mm -64.47 119.66 58.69 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 123.278 0.631 . . . . 0.0 109.981 -172.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -72.9 -6.38 18.91 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.719 2.279 . . . . 0.0 112.699 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -96.48 -14.6 22.24 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.756 0.822 . . . . 0.0 110.872 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.516 HD23 HD11 ' A' ' 15' ' ' LEU . 3.1 tm? -84.93 85.29 7.49 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -178.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.43 ' H ' ' HB2' ' A' ' 41' ' ' ALA . 8.3 t70 -108.79 -173.19 2.21 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.377 1.071 . . . . 0.0 108.846 177.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.528 ' O ' HG23 ' A' ' 42' ' ' VAL . 39.8 t -49.37 -70.93 0.07 Allowed 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 125.711 1.604 . . . . 0.0 114.5 -173.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -62.75 -25.58 68.27 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 121.708 -0.62 . . . . 0.0 111.358 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.43 ' HB2' ' H ' ' A' ' 38' ' ' ASP . . . -69.43 -29.53 67.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.312 0.645 . . . . 0.0 112.355 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 39' ' ' SER . 3.0 m -65.98 -40.5 87.53 Favored 'Isoleucine or valine' 0 C--N 1.37 1.478 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 172.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.459 HG22 H313 ' A' ' 84' ' ' PNS . 4.9 t -67.15 -40.43 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.463 -178.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -65.12 -43.12 92.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.272 . . . . 0.0 112.037 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.0 m -72.52 -33.13 44.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.089 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.512 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -60.92 -48.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 173.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.459 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 68.1 m -55.77 -44.04 77.29 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 124.301 1.001 . . . . 0.0 110.528 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.57 86.54 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.212 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.426 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -54.21 -50.63 66.66 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 172.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -54.89 -46.04 74.76 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.17 177.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 47' ' ' THR . 30.0 mm-40 -61.66 -60.58 3.46 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.061 0.944 . . . . 0.0 112.093 -177.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -66.91 -46.29 75.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -172.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.498 ' HB3' HD13 ' A' ' 81' ' ' LEU . 93.4 m-85 -84.1 -19.64 33.92 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-O 119.082 -0.485 . . . . 0.0 112.078 -177.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.56 47.74 1.59 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.248 1.019 . . . . 0.0 111.633 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.436 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.5 OUTLIER -137.6 -174.27 3.72 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.906 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.8 t -134.84 117.08 15.52 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 122.767 0.427 . . . . 0.0 110.962 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.431 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 11.7 t -68.96 132.79 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 33.5 t70 -76.26 147.08 38.53 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.592 0.357 . . . . 0.0 110.392 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -57.39 -42.34 81.98 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.199 0.599 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.08 -14.96 62.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.209 0.604 . . . . 0.0 112.289 -174.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.8 pt-20 -103.31 -11.34 17.99 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.864 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 54.5 mt -85.92 116.17 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.234 0.614 . . . . 0.0 110.392 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -145.85 -178.96 6.38 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.879 1.272 . . . . 0.0 108.849 171.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.478 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -65.18 -34.37 78.22 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 171.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -71.94 -11.17 60.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.671 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.6 m -76.29 -36.67 58.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.226 0.61 . . . . 0.0 110.058 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.51 ' HA ' HD22 ' A' ' 73' ' ' LEU . 40.9 m-85 -99.79 14.76 29.18 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.948 0.499 . . . . 0.0 112.082 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -60.89 -45.62 93.86 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.432 0.293 . . . . 0.0 110.659 -178.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.0 p -138.04 163.59 31.22 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.784 0.833 . . . . 0.0 110.168 176.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 55.0 tp -59.29 -37.18 77.06 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.029 176.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.1 -34.3 89.57 Favored Glycine 0 C--N 1.34 0.753 0 CA-C-N 114.684 -1.144 . . . . 0.0 112.346 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -60.31 -54.89 40.24 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 122.859 0.464 . . . . 0.0 109.885 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.51 HD22 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.96 -44.3 91.46 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 124.025 0.828 . . . . 0.0 110.313 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.592 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -54.5 -46.87 73.55 Favored 'General case' 0 C--O 1.217 -0.636 0 O-C-N 124.64 1.212 . . . . 0.0 110.969 -178.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.475 HD21 ' SD ' ' A' ' 1' ' ' MET . 3.6 mm? -65.87 -47.64 74.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.813 0.845 . . . . 0.0 111.346 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.503 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 52.6 m-85 -56.39 -53.03 62.14 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.7 m -70.68 -23.81 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.653 0.781 . . . . 0.0 112.205 -177.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -54.19 -52.88 59.8 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -70.64 -29.6 66.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.989 -1.46 . . . . 0.0 112.114 -173.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -72.04 -58.09 3.73 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.478 0.711 . . . . 0.0 110.847 178.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.498 HD13 ' HB3' ' A' ' 53' ' ' PHE . 3.9 mm? -68.2 -11.24 58.95 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.556 -176.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.3 m -55.26 -40.6 71.16 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.131 0.572 . . . . 0.0 111.113 167.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 . . . . . 0 C--O 1.253 1.239 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.169 178.054 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PNS . . . . . 0.478 ' S44' ' HA ' ' A' ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.949 0.404 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -94.1 -55.03 3.35 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.888 0.851 . . . . 0.0 109.343 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.403 ' O ' HG23 ' A' ' 7' ' ' VAL . 9.9 m-70 -78.21 -9.2 59.1 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.593 -163.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -53.2 -32.48 48.25 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.551 0.74 . . . . 0.0 111.887 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -66.12 -50.64 63.32 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 124.576 1.151 . . . . 0.0 111.074 -177.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.71 -29.58 63.5 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.503 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 3' ' ' HIS . 90.1 t -67.82 -48.28 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.845 0.458 . . . . 0.0 109.995 177.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -70.3 -28.26 65.04 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.542 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 44.0 t30 -63.13 -46.52 86.88 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.326 0.651 . . . . 0.0 109.831 173.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.57 -53.86 42.45 Favored 'Isoleucine or valine' 0 C--N 1.351 0.643 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.258 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.54 -34.8 79.09 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.195 0.31 . . . . 0.0 110.551 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.56 -20.53 71.96 Favored Glycine 0 C--N 1.343 0.963 0 CA-C-O 119.947 -0.363 . . . . 0.0 113.398 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -86.06 -56.9 3.24 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.634 0.774 . . . . 0.0 111.059 173.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.07 -54.0 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.602 1.161 . . . . 0.0 111.141 -173.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 64.6 mt -80.61 -14.53 58.1 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 64.22 62.0 0.87 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.835 1.254 . . . . 0.0 110.863 172.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.635 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 1.7 mm? -86.26 -26.09 25.19 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.3 172.247 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.43 -83.94 0.14 Allowed Glycine 0 C--N 1.348 1.217 0 O-C-N 124.048 0.843 . . . . 0.0 113.256 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.18 -25.67 14.19 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.641 0.776 . . . . 0.0 111.025 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.635 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.26 -28.03 68.4 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.209 0.603 . . . . 0.0 111.078 -175.388 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.3 pttt -58.76 -34.0 70.91 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.228 0.611 . . . . 0.0 111.369 173.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -90.81 -10.61 42.16 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.98 0.912 . . . . 0.0 111.803 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.5 t -97.51 -7.06 32.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.701 0.401 . . . . 0.0 111.52 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -103.07 147.57 26.8 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 49.8 p -113.82 -172.56 2.11 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.673 0.789 . . . . 0.0 110.653 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.88 -53.46 57.04 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 123.313 0.645 . . . . 0.0 111.658 -178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -69.54 -5.46 24.41 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -77.95 150.42 34.0 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-O 121.014 0.435 . . . . 0.0 110.365 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.408 ' HB ' ' HB2' ' A' ' 33' ' ' ASN . 90.2 t -83.49 151.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.928 -174.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.428 HD12 HD23 ' A' ' 73' ' ' LEU . 95.1 mt -114.82 -62.53 1.59 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.024 0.53 . . . . 0.0 109.614 173.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.444 ' HG ' HD12 ' A' ' 37' ' ' LEU . 3.4 tt -65.61 110.48 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.77 -40.71 2.37 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 116.366 -0.379 . . . . 0.0 112.522 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.408 ' HB2' ' HB ' ' A' ' 29' ' ' VAL . 62.6 t30 -77.63 -40.71 40.96 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.13 0.49 . . . . 0.0 110.54 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.54 HG22 ' H ' ' A' ' 36' ' ' GLU . 39.8 mm -84.51 121.92 75.01 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 175.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.05 -17.42 31.77 Favored 'Trans proline' 0 C--N 1.371 1.744 0 C-N-CA 122.648 2.232 . . . . 0.0 112.155 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 19.5 mm-40 -93.92 -12.53 28.63 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.987 0.915 . . . . 0.0 111.389 -172.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.444 HD12 ' HG ' ' A' ' 31' ' ' LEU . 2.9 tm? -76.92 94.89 4.0 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.509 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 16.6 t70 -132.45 -168.82 2.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.184 0.994 . . . . 0.0 110.005 -171.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.558 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -56.07 -72.92 0.07 Allowed 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 125.988 1.715 . . . . 0.0 114.599 -170.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.45 -21.11 62.83 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 121.165 -0.959 . . . . 0.0 110.845 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.509 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -68.37 -34.62 76.39 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.342 177.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 39' ' ' SER . 34.3 m -70.58 -38.06 72.07 Favored 'Isoleucine or valine' 0 C--N 1.372 1.556 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -59.46 -43.34 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.417 0.627 . . . . 0.0 110.161 176.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.26 -45.94 85.91 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.053 -1.43 . . . . 0.0 111.482 -175.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.74 -33.62 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-O 118.894 -0.574 . . . . 0.0 111.533 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.524 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.5 mt -60.42 -52.25 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 40.1 m -54.18 -46.23 72.31 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 124.646 1.217 . . . . 0.0 110.224 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.404 ' O ' ' HD2' ' A' ' 52' ' ' TYR . . . -59.89 -42.77 94.55 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.073 0.949 . . . . 0.0 112.251 178.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.402 HD11 HG22 ' A' ' 7' ' ' VAL . 3.6 mm? -55.84 -46.82 78.07 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.348 0.659 . . . . 0.0 110.213 175.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.1 mm-40 -56.82 -45.89 82.01 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 124.128 0.892 . . . . 0.0 110.529 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 47' ' ' THR . 67.2 mm-40 -59.09 -64.11 1.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 O-C-N 124.245 0.966 . . . . 0.0 111.281 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.404 ' HD2' ' O ' ' A' ' 48' ' ' ALA . 83.1 m-85 -66.96 -37.46 84.3 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.653 0.781 . . . . 0.0 112.719 -169.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.403 ' HB2' ' CE1' ' A' ' 55' ' ' PHE . 37.6 m-85 -91.65 -6.05 52.82 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 119.35 -0.357 . . . . 0.0 111.797 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 63.11 34.63 13.53 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.298 1.039 . . . . 0.0 111.841 169.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -135.14 -171.98 2.94 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.407 -175.098 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.8 t -135.66 126.21 26.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.42 0.288 . . . . 0.0 110.481 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.3 t -77.53 132.93 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.447 ' O ' HG13 ' A' ' 62' ' ' ILE . 20.5 t70 -71.81 143.72 49.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.04 0.536 . . . . 0.0 110.52 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.7 -41.64 82.12 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.888 0.875 . . . . 0.0 112.1 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -75.56 1.4 14.42 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.918 0.887 . . . . 0.0 112.516 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.92 -11.09 8.99 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.696 0.398 . . . . 0.0 111.43 172.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 58' ' ' ASP . 50.9 mt -82.37 113.86 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.7 t -136.09 175.15 9.87 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.869 0.868 . . . . 0.0 109.216 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.69 76.5 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 170.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -64.89 -21.36 66.8 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.59 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 58.3 m -68.11 -36.74 80.24 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.848 0.459 . . . . 0.0 110.356 177.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.598 ' HA ' HD21 ' A' ' 73' ' ' LEU . 87.2 m-85 -95.67 16.63 16.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.978 0.511 . . . . 0.0 112.305 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -61.88 -46.67 88.38 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.227 0.33 . . . . 0.0 110.88 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.0 p -139.48 163.44 32.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.958 0.903 . . . . 0.0 110.407 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.4 tp -64.93 -31.01 72.04 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.581 0.752 . . . . 0.0 110.909 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.67 -29.54 69.49 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.716 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.0 m -64.1 -52.94 56.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.996 0.519 . . . . 0.0 110.3 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.598 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -59.3 -45.36 91.49 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 123.316 0.385 . . . . 0.0 110.811 177.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.37 87.06 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.195 0.934 . . . . 0.0 111.094 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -61.05 -53.46 56.92 Favored 'General case' 0 C--N 1.352 0.674 0 O-C-N 123.744 0.652 . . . . 0.0 109.809 178.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.482 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.2 m-85 -55.29 -52.65 62.75 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.152 0.908 . . . . 0.0 111.586 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.4 m -65.27 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 123.355 0.409 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.34 -18.65 59.94 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.607 0.363 . . . . 0.0 111.731 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -80.29 -37.86 31.91 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.314 0.506 . . . . 0.0 109.662 171.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.6 mmmt -62.57 -58.32 7.99 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.095 0.958 . . . . 0.0 111.765 -176.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.02 -14.91 62.51 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.105 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 122.932 0.493 . . . . 0.0 111.624 176.572 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.106 0.479 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -96.09 -55.04 3.09 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -70.85 -10.17 59.04 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.226 -1.352 . . . . 0.0 114.125 -165.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.0 -34.64 43.63 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.64 -34.87 67.6 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 120.825 0.345 . . . . 0.0 110.487 -175.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.71 -30.6 56.74 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.63 0.772 . . . . 0.0 110.71 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 95.5 t -67.02 -47.93 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -72.64 -26.0 61.49 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 122.662 0.385 . . . . 0.0 110.717 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.45 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.7 t30 -62.25 -47.55 83.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.158 0.583 . . . . 0.0 109.577 171.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.86 -47.44 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.979 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.63 -38.83 89.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.237 0.615 . . . . 0.0 110.534 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.568 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.84 -19.69 78.3 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.815 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -84.28 -52.06 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.404 0.682 . . . . 0.0 110.975 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.5 t -69.72 -49.28 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.906 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.581 HD11 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -90.89 -6.51 54.07 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.144 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 64.61 65.62 0.63 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.126 0.97 . . . . 0.0 111.298 174.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.568 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 8.8 mp -85.75 -38.81 17.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.62 0.768 . . . . 0.0 110.799 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.68 -90.38 0.56 Allowed Glycine 0 C--N 1.35 1.322 0 O-C-N 123.31 0.381 . . . . 0.0 112.652 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.31 -19.92 16.81 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.903 0.881 . . . . 0.0 110.454 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -64.87 -31.95 73.43 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.459 0.704 . . . . 0.0 109.801 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.8 pttt -68.97 -32.88 72.78 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.793 0.437 . . . . 0.0 110.765 174.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -79.84 -29.75 40.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.171 0.589 . . . . 0.0 110.659 -173.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 t -81.63 -16.28 51.95 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.943 -177.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 pp -95.54 155.92 16.54 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.72 0.295 . . . . 0.0 110.867 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.5 p -117.65 -172.35 2.22 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.263 1.025 . . . . 0.0 111.086 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.21 75.39 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.345 0.658 . . . . 0.0 111.779 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -80.19 3.84 19.41 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.546 0.738 . . . . 0.0 112.266 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.2 t -75.38 136.65 40.77 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.691 0.396 . . . . 0.0 110.408 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.03 147.57 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.7 mt -108.26 -67.78 0.95 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 122.243 -0.286 . . . . 0.0 110.365 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.4 mt -56.73 116.33 3.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.812 0.445 . . . . 0.0 111.07 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.66 -23.43 19.64 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-N 115.331 -0.849 . . . . 0.0 113.807 176.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -77.2 -55.85 5.07 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 170.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 24.8 mm -76.52 118.08 69.04 Favored Pre-proline 0 C--O 1.241 0.634 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 176.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.48 -4.38 14.96 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.541 2.161 . . . . 0.0 112.517 -173.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.535 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 46.7 mm-40 -105.98 -15.85 14.79 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.972 0.909 . . . . 0.0 111.157 -175.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.0 tp -80.36 87.98 5.59 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 110.112 -175.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -99.62 -171.02 1.98 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.934 0.893 . . . . 0.0 111.201 174.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 42' ' ' VAL . 78.0 p -66.12 -53.05 42.69 Favored 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.454 1.101 . . . . 0.0 112.096 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -59.64 -30.52 68.79 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.709 0.766 . . . . 0.0 110.578 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.581 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -69.14 -26.91 65.12 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.634 174.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 39' ' ' SER . 2.2 m -65.8 -38.34 81.99 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.5 t -62.61 -47.05 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 CA-C-O 121.259 0.552 . . . . 0.0 110.041 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.67 -51.47 68.65 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.797 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.6 m -68.26 -35.91 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.401 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.553 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -62.31 -45.77 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 54.3 m -57.87 -46.14 85.3 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 124.064 0.853 . . . . 0.0 110.595 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.0 -37.08 86.12 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -57.89 -50.67 72.54 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.236 0.614 . . . . 0.0 109.661 172.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.8 mm-40 -50.55 -51.21 50.02 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.61 1.164 . . . . 0.0 110.78 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' THR . 12.5 mm-40 -65.58 -53.49 41.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.454 -174.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -65.66 -46.24 79.91 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.51 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 2.9 m-85 -91.52 -13.8 31.48 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.628 -175.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 65.65 39.96 4.66 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.448 1.099 . . . . 0.0 111.418 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.51 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -131.94 179.36 6.13 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.686 0.794 . . . . 0.0 110.085 -177.108 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.9 t -130.53 112.22 12.99 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.988 0.18 . . . . 0.0 111.25 175.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.479 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.3 t -70.36 114.08 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.494 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.5 t70 -69.03 147.24 51.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 -168.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.041 0.536 . . . . 0.0 112.408 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.92 -7.97 39.9 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.788 0.835 . . . . 0.0 113.233 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -115.02 -11.66 12.09 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.987 0.515 . . . . 0.0 111.825 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 58' ' ' ASP . 51.9 mt -88.51 125.51 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 120.737 0.303 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.7 t -143.49 176.95 8.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.784 1.234 . . . . 0.0 108.948 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.99 -32.16 73.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.692 0.758 . . . . 0.0 109.38 167.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -69.2 -16.31 63.58 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 114.598 -1.183 . . . . 0.0 111.485 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 88.5 m -74.85 -39.2 61.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.405 0.682 . . . . 0.0 109.699 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.558 ' HA ' HD21 ' A' ' 73' ' ' LEU . 96.4 m-85 -93.96 17.29 12.52 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.848 0.859 . . . . 0.0 112.751 -176.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.08 -46.58 83.66 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 122.135 0.174 . . . . 0.0 110.688 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.1 p -138.35 161.11 37.77 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.44 0.696 . . . . 0.0 111.301 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.6 tp -57.75 -42.66 84.4 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.0 0.92 . . . . 0.0 110.816 175.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.62 -31.08 78.67 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.497 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -63.09 -53.59 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.968 0.507 . . . . 0.0 110.401 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.558 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.9 mm? -57.57 -42.58 83.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.4 0.438 . . . . 0.0 110.119 177.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.558 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.45 -42.45 98.79 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.43 -177.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -48.29 78.26 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.098 0.559 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.531 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 37.2 m-85 -53.59 -54.6 35.27 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 123.733 0.646 . . . . 0.0 110.26 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.51 -25.85 34.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.109 0.563 . . . . 0.0 112.372 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 62.8 mm-40 -56.97 -51.45 69.17 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 169.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -67.3 -30.36 70.19 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.835 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.7 mmmt -64.63 -56.88 11.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.613 0.765 . . . . 0.0 112.226 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.2 -13.37 62.37 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.333 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 122.859 0.463 . . . . 0.0 110.638 169.884 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.414 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.861 0.362 . . . . 0.0 110.173 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.23 -37.55 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.267 1.027 . . . . 0.0 110.467 177.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -70.96 -22.01 62.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -168.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -51.9 -31.74 29.65 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.032 0.933 . . . . 0.0 113.138 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' HG3' ' HE ' ' A' ' 8' ' ' ARG . 37.3 tt0 -75.12 -40.31 59.94 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 122.87 0.468 . . . . 0.0 111.25 -175.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.65 -28.61 64.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.992 0.517 . . . . 0.0 111.03 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.472 HG22 HD11 ' A' ' 49' ' ' LEU . 90.0 t -66.9 -49.24 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 41.8 ptt180 -71.03 -25.12 62.52 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.543 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.2 t30 -61.85 -49.32 76.76 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 123.335 0.654 . . . . 0.0 109.318 173.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.0 mt -60.54 -51.44 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.633 177.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.9 -34.24 77.69 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.224 0.21 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.587 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -72.4 -21.46 79.4 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-O 120.196 -0.224 . . . . 0.0 113.262 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.02 -57.14 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.4 0.68 . . . . 0.0 110.176 176.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 97.1 t -71.11 -47.38 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.741 1.216 . . . . 0.0 110.534 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.43 HD11 HD13 ' A' ' 37' ' ' LEU . 44.1 mt -83.46 -6.5 59.47 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.553 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 63.41 59.91 1.19 Allowed 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.58 1.152 . . . . 0.0 110.916 172.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.7 mp -89.65 -29.61 18.69 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.45 173.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.0 -89.88 0.21 Allowed Glycine 0 C--N 1.351 1.406 0 O-C-N 123.978 0.799 . . . . 0.0 112.31 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -101.17 -18.94 15.95 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.928 0.891 . . . . 0.0 110.857 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.86 -26.93 69.01 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.233 0.613 . . . . 0.0 111.095 -177.411 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.1 pttt -62.87 -34.91 78.36 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 123.246 0.618 . . . . 0.0 111.313 173.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -69.7 -29.1 66.43 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.386 1.074 . . . . 0.0 110.995 -176.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -93.26 -6.57 47.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -174.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -99.34 153.53 18.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 176.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.2 p -112.9 -176.07 2.81 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 111.184 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.95 -50.24 74.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.796 0.838 . . . . 0.0 110.668 173.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.1 m -71.54 -12.48 61.39 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.205 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -69.75 140.93 53.5 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 123.311 0.644 . . . . 0.0 110.168 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 63.6 t -79.37 152.21 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.364 1.066 . . . . 0.0 109.848 -176.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.28 -65.74 1.16 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.437 0.695 . . . . 0.0 109.862 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.1 mt -60.56 111.71 1.7 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.05 0.452 . . . . 0.0 110.703 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 103.03 -30.53 10.23 Favored Glycine 0 C--N 1.333 0.416 0 CA-C-N 115.061 -0.972 . . . . 0.0 112.79 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -79.54 -53.61 6.7 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.005 0.431 . . . . 0.0 110.058 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.441 HG22 ' H ' ' A' ' 36' ' ' GLU . 26.8 mm -87.29 120.82 71.45 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.72 -14.83 33.36 Favored 'Trans proline' 0 C--N 1.372 1.765 0 C-N-CA 122.39 2.06 . . . . 0.0 112.22 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.441 ' H ' HG22 ' A' ' 34' ' ' ILE . 19.6 mm-40 -85.83 -18.23 33.47 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 -174.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.43 HD13 HD11 ' A' ' 15' ' ' LEU . 40.2 tp -83.28 80.18 9.16 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 122.036 0.922 . . . . 0.0 110.272 -175.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -93.8 177.31 6.04 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.976 1.71 . . . . 0.0 109.681 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.662 ' O ' HG22 ' A' ' 42' ' ' VAL . 3.6 m -44.34 -64.11 0.75 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.827 1.251 . . . . 0.0 113.35 170.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.8 mmt -65.92 -26.83 67.78 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 121.512 -0.742 . . . . 0.0 111.236 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.18 -38.32 87.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.286 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 39' ' ' SER . 15.1 m -67.07 -35.06 73.52 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 176.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 t -62.17 -48.49 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 121.688 0.756 . . . . 0.0 110.177 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -59.62 -46.36 89.2 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 113.656 -1.611 . . . . 0.0 112.475 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.7 m -73.67 -30.86 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.127 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.455 HD13 HD13 ' A' ' 62' ' ' ILE . 96.4 mt -63.41 -48.77 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.7 m -55.84 -47.01 77.99 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.421 1.076 . . . . 0.0 110.153 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 -40.67 97.3 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.864 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD11 HG22 ' A' ' 7' ' ' VAL . 2.1 mm? -56.16 -49.91 72.63 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.284 0.564 . . . . 0.0 109.858 175.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -63.53 -38.67 92.0 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.594 -1.185 . . . . 0.0 112.249 -178.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -66.77 -54.57 21.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.406 0.682 . . . . 0.0 111.072 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -57.63 -57.6 12.01 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.788 0.835 . . . . 0.0 111.325 -177.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -82.55 -15.01 53.9 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.204 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 64.0 58.84 1.15 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.854 0.862 . . . . 0.0 111.427 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.472 ' CE2' HG22 ' A' ' 57' ' ' VAL . 8.9 p90 -142.95 -177.69 5.46 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.311 173.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.3 m -131.0 121.19 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.882 0.473 . . . . 0.0 110.311 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.472 HG22 ' CE2' ' A' ' 55' ' ' PHE . 2.1 t -77.69 127.31 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 29.4 t70 -89.83 153.75 20.42 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 122.799 0.44 . . . . 0.0 110.651 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -58.41 -34.29 70.6 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.043 0.937 . . . . 0.0 113.223 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -59.75 -33.76 72.08 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.837 0.855 . . . . 0.0 112.156 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.0 pt-20 -97.99 -15.86 19.91 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.462 0.705 . . . . 0.0 110.822 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.455 HD13 HD13 ' A' ' 46' ' ' ILE . 38.4 mt -83.84 119.7 33.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 123.09 0.556 . . . . 0.0 111.061 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 82.9 p -155.29 -172.0 4.01 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.055 0.942 . . . . 0.0 109.378 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.48 -29.72 69.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.058 0.456 . . . . 0.0 110.38 171.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -67.94 -13.44 62.16 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.832 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.1 m -79.26 -41.47 28.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 0.0 110.105 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.466 ' HA ' HD21 ' A' ' 73' ' ' LEU . 78.6 m-85 -99.31 15.53 25.91 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.254 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.94 -49.6 76.8 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 123.055 0.222 . . . . 0.0 110.904 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 74.5 p -138.14 164.29 29.53 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.534 0.734 . . . . 0.0 110.515 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 tp -62.82 -34.5 77.44 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.205 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.02 -31.91 79.29 Favored Glycine 0 C--N 1.341 0.85 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.399 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -62.57 -53.01 61.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.164 0.586 . . . . 0.0 110.103 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.466 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.48 -41.91 81.63 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 123.357 0.41 . . . . 0.0 110.612 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.558 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.22 -44.95 92.29 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 124.048 0.843 . . . . 0.0 110.891 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.84 -54.95 41.08 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.195 0.998 . . . . 0.0 110.118 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 66.2 m-85 -53.83 -55.87 22.7 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.013 0.82 . . . . 0.0 110.753 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 19.6 m -66.48 -25.98 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 79.3 mm-40 -59.17 -52.67 64.7 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -60.8 -38.99 87.23 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.102 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.515 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -67.93 -52.43 36.23 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.598 0.759 . . . . 0.0 111.606 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.37 -17.96 62.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.989 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 CA--C 1.547 0.839 0 C-N-CA 122.819 0.448 . . . . 0.0 111.059 171.567 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -100.99 -21.52 15.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.414 0.686 . . . . 0.0 111.402 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -90.72 -14.84 31.36 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 118.209 -0.901 . . . . 0.0 113.086 -174.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.52 -28.22 43.77 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 118.785 0.721 . . . . 0.0 112.203 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 39.3 tt0 -67.97 -46.84 70.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.764 0.825 . . . . 0.0 110.601 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.61 70.43 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.426 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 89.2 t -66.26 -48.38 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 122.864 0.465 . . . . 0.0 109.788 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 5' ' ' GLU . 37.1 ptt180 -69.08 -26.76 65.1 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 123.533 0.521 . . . . 0.0 110.144 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -61.42 -51.39 68.92 Favored 'General case' 0 C--N 1.351 0.644 0 C-N-CA 123.532 0.733 . . . . 0.0 109.506 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.5 mt -62.73 -49.12 84.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.105 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.84 -45.9 87.44 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.06 0.544 . . . . 0.0 111.047 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.493 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -69.93 -18.42 74.4 Favored Glycine 0 C--N 1.337 0.605 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.442 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -81.14 -53.22 6.57 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 117.293 0.546 . . . . 0.0 110.228 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.65 -49.8 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 124.066 0.946 . . . . 0.0 111.141 -173.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.531 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -82.76 -7.4 59.66 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.892 0.477 . . . . 0.0 111.159 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 t30 62.23 64.03 1.01 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.668 1.187 . . . . 0.0 111.644 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.555 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 9.6 mp -88.66 -31.43 18.52 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.91 170.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.93 -99.62 0.5 Allowed Glycine 0 C--N 1.352 1.431 0 O-C-N 123.552 0.533 . . . . 0.0 113.617 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.15 -23.18 35.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.056 0.943 . . . . 0.0 110.689 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.555 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.56 -30.21 69.78 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 122.944 0.498 . . . . 0.0 111.234 -175.384 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.493 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.1 pttt -65.15 -26.21 68.08 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 120.689 0.281 . . . . 0.0 111.341 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -79.5 -33.74 41.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.265 0.626 . . . . 0.0 110.691 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 t -83.2 -8.59 59.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -173.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.4 pp -96.23 166.78 11.57 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 120.969 0.414 . . . . 0.0 110.524 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 73.3 p -115.1 -178.91 3.48 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.113 0.965 . . . . 0.0 110.335 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.89 -14.94 57.46 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.139 0.576 . . . . 0.0 112.209 174.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.4 t -90.9 8.25 35.99 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.045 0.538 . . . . 0.0 111.587 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 94.1 p -78.87 121.2 24.54 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.62 0.368 . . . . 0.0 110.15 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.02 145.71 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.458 ' HA ' HG12 ' A' ' 34' ' ' ILE . 55.2 mt -101.69 -70.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.6 mt -57.94 114.95 2.56 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 122.954 0.501 . . . . 0.0 111.393 178.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.05 -38.1 3.22 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.121 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -75.92 -51.99 11.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.906 0.482 . . . . 0.0 109.913 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.458 HG12 ' HA ' ' A' ' 30' ' ' LEU . 19.6 mm -79.08 112.23 26.24 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 175.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.34 2.27 8.62 Favored 'Trans proline' 0 C--N 1.369 1.652 0 C-N-CA 122.764 2.309 . . . . 0.0 112.113 -177.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 23.4 mm-40 -97.12 -19.41 18.69 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 123.802 0.841 . . . . 0.0 109.688 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.34 96.86 6.79 Favored 'General case' 0 C--N 1.352 0.697 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -90.77 173.87 7.78 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.801 1.24 . . . . 0.0 109.615 172.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.615 ' O ' HG22 ' A' ' 42' ' ' VAL . 86.6 p -59.21 -49.13 79.01 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.508 0.723 . . . . 0.0 111.081 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.3 mmt -60.51 -31.19 70.26 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.9 -0.5 . . . . 0.0 110.724 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.531 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -69.57 -29.01 66.48 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.346 176.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 39' ' ' SER . 2.3 m -63.8 -37.2 79.09 Favored 'Isoleucine or valine' 0 C--N 1.372 1.584 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 t -66.92 -47.46 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.174 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.59 -42.78 88.84 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.031 -1.441 . . . . 0.0 112.173 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -75.7 -31.01 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.654 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.578 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.8 mt -59.79 -54.43 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 172.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 37.7 m -51.37 -49.2 61.96 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 124.673 1.233 . . . . 0.0 110.868 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.78 -43.78 98.18 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.014 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -55.59 -47.97 75.61 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.144 0.578 . . . . 0.0 110.333 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -59.4 -43.83 92.91 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.983 0.913 . . . . 0.0 111.241 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' THR . 33.2 mm-40 -65.12 -59.12 4.46 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.597 0.759 . . . . 0.0 111.097 -177.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -67.34 -44.85 78.06 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.554 0.741 . . . . 0.0 112.288 -171.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -82.56 -21.14 35.42 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 119.402 -0.332 . . . . 0.0 111.309 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.7 t70 64.03 64.1 0.77 Allowed 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.261 1.024 . . . . 0.0 110.615 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.02 -174.3 4.93 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.7 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -130.49 119.96 23.41 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.217 0.607 . . . . 0.0 110.698 170.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.2 t -70.72 126.37 30.84 Favored 'Isoleucine or valine' 0 C--N 1.353 0.755 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 165.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.3 t70 -73.54 144.57 46.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 122.564 0.346 . . . . 0.0 110.848 -174.038 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -51.16 -42.66 60.95 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.067 0.947 . . . . 0.0 112.973 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.83 -19.91 63.45 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.798 0.839 . . . . 0.0 112.701 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.2 pt-20 -102.55 -7.4 21.88 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.82 0.448 . . . . 0.0 111.15 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 58' ' ' ASP . 75.4 mt -85.81 105.39 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.7 t -133.16 170.57 15.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.016 0.926 . . . . 0.0 109.599 174.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.72 -32.11 71.38 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.472 0.654 . . . . 0.0 109.996 170.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.74 -12.58 61.38 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.599 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.416 HG22 HD13 ' A' ' 73' ' ' LEU . 42.1 m -74.72 -42.18 58.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.577 ' HA ' HD21 ' A' ' 73' ' ' LEU . 92.2 m-85 -92.72 20.94 5.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.096 0.958 . . . . 0.0 112.31 -176.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.458 ' HG3' HG22 ' A' ' 69' ' ' THR . 7.6 pt-20 -65.14 -45.21 85.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.292 0.237 . . . . 0.0 110.633 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.458 HG22 ' HG3' ' A' ' 68' ' ' GLU . 11.5 t -150.13 158.53 44.25 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.064 0.546 . . . . 0.0 110.873 -179.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 tp -52.33 -40.34 61.8 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.547 1.139 . . . . 0.0 111.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.96 -41.82 96.52 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 114.607 -1.179 . . . . 0.0 111.794 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.425 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 50.5 m -60.1 -50.29 74.3 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.001 0.52 . . . . 0.0 111.035 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.577 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -58.06 -40.17 80.31 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 122.604 0.361 . . . . 0.0 110.395 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.555 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.92 -48.64 80.9 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.308 1.005 . . . . 0.0 110.632 178.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.12 -45.59 87.03 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 124.042 0.937 . . . . 0.0 111.002 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.481 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.5 m-85 -56.71 -57.35 12.79 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.294 177.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.7 m -67.6 -23.11 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.3 mm-40 -57.39 -51.28 70.06 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.48 -51.84 63.88 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.312 -176.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.57 -48.49 79.21 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 0.0 112.451 -171.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -78.1 -16.72 57.74 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.155 -178.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 122.82 0.448 . . . . 0.0 111.493 172.231 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 121.437 0.637 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -95.1 -46.59 6.73 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.152 171.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -74.83 -17.72 60.56 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 113.549 -1.659 . . . . 0.0 113.507 -164.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.24 -37.72 37.06 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.991 0.916 . . . . 0.0 112.487 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -75.17 -41.1 58.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.712 -174.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.54 66.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.367 0.667 . . . . 0.0 111.414 174.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.7 t -70.46 -50.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.082 0.553 . . . . 0.0 109.536 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -67.08 -27.41 67.34 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.32 -58.56 6.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.011 0.924 . . . . 0.0 109.727 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.405 ' O ' HG23 ' A' ' 14' ' ' VAL . 95.3 mt -61.28 -49.77 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.951 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.12 -41.78 89.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.308 0.643 . . . . 0.0 111.126 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.527 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.61 -19.99 79.69 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 121.556 -0.354 . . . . 0.0 113.42 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -75.73 -48.64 21.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.949 0.5 . . . . 0.0 110.446 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 10' ' ' ILE . 57.3 t -67.47 -48.63 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 123.523 0.729 . . . . 0.0 110.38 -177.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.511 ' HB2' HD13 ' A' ' 17' ' ' LEU . 44.2 mt -84.5 0.04 51.25 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.227 -177.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 66.76 24.84 9.83 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.366 1.066 . . . . 0.0 111.507 170.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.511 HD13 ' HB2' ' A' ' 15' ' ' LEU . 9.6 mp -60.11 -41.31 92.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.222 0.609 . . . . 0.0 110.706 174.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.16 -81.68 0.03 OUTLIER Glycine 0 C--N 1.354 1.546 0 O-C-N 124.196 0.935 . . . . 0.0 114.089 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -87.47 -35.83 18.02 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.026 0.93 . . . . 0.0 110.252 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.09 -28.29 69.98 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.123 0.969 . . . . 0.0 110.904 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.527 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 54.9 pttt -70.33 -31.99 69.53 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.806 0.442 . . . . 0.0 111.864 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -80.02 -31.5 39.6 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.102 0.561 . . . . 0.0 110.726 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.1 t -85.65 -5.88 59.21 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.207 0.603 . . . . 0.0 112.45 -175.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -98.07 155.99 16.87 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.236 0.471 . . . . 0.0 110.084 176.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.8 p -112.94 -175.64 2.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.619 0.767 . . . . 0.0 110.921 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -35.77 76.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.273 0.629 . . . . 0.0 110.944 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.6 m -75.95 -15.8 60.11 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.368 -0.833 . . . . 0.0 112.242 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.9 p -67.82 140.63 56.61 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.859 0.299 . . . . 0.0 110.825 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -84.26 143.06 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 123.782 0.833 . . . . 0.0 109.341 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.428 ' HA ' HG12 ' A' ' 34' ' ' ILE . 49.2 mt -110.35 -70.27 0.82 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.828 0.451 . . . . 0.0 109.873 178.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.01 112.52 1.22 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.393 1.077 . . . . 0.0 110.699 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 -40.47 2.48 Favored Glycine 0 C--N 1.345 1.081 0 O-C-N 123.541 0.526 . . . . 0.0 112.745 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -78.14 -59.07 2.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.262 0.625 . . . . 0.0 110.475 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.456 HG22 ' H ' ' A' ' 36' ' ' GLU . 31.9 mm -76.26 120.28 80.96 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.32 -13.38 35.69 Favored 'Trans proline' 0 C--N 1.37 1.699 0 C-N-CA 122.726 2.284 . . . . 0.0 112.441 -177.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.456 ' H ' HG22 ' A' ' 34' ' ' ILE . 21.8 mm-40 -86.75 -13.92 43.87 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.53 0.732 . . . . 0.0 111.27 -177.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.41 81.7 5.64 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 17.5 t70 -96.04 170.88 8.97 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.65 1.58 . . . . 0.0 109.92 178.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.627 ' O ' HG22 ' A' ' 42' ' ' VAL . 6.1 m -46.56 -67.81 0.25 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.712 1.205 . . . . 0.0 113.019 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.0 mmm -66.13 -24.07 66.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.801 -0.562 . . . . 0.0 111.501 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.423 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -65.42 -37.06 85.82 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 124.069 0.856 . . . . 0.0 112.251 174.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.627 HG22 ' O ' ' A' ' 39' ' ' SER . 7.7 m -68.7 -37.61 77.77 Favored 'Isoleucine or valine' 0 C--N 1.367 1.347 0 CA-C-N 118.445 0.566 . . . . 0.0 109.776 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -61.18 -45.29 98.88 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.592 0.711 . . . . 0.0 109.374 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.4 -50.14 74.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 113.605 -1.634 . . . . 0.0 113.085 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.7 m -71.82 -30.51 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.619 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -63.48 -50.59 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.3 m -53.24 -48.68 68.01 Favored 'General case' 0 C--N 1.351 0.656 0 O-C-N 124.421 1.076 . . . . 0.0 110.929 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.41 -43.74 98.1 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.115 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -57.13 -46.5 82.63 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.463 0.705 . . . . 0.0 110.59 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.88 -44.64 91.16 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.034 0.934 . . . . 0.0 111.222 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 47' ' ' THR . 37.6 mm-40 -59.31 -61.34 2.7 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.63 0.772 . . . . 0.0 111.353 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -67.3 -51.56 51.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.874 -171.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 m-30 -75.2 -16.26 60.5 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.522 0.329 . . . . 0.0 111.551 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.0 t70 68.12 66.73 0.34 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.268 1.027 . . . . 0.0 110.63 175.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.481 ' CE2' HG22 ' A' ' 57' ' ' VAL . 7.7 p90 -157.01 -170.28 3.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.015 172.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.88 138.66 45.71 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 167.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.481 HG22 ' CE2' ' A' ' 55' ' ' PHE . 2.9 t -89.69 122.69 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 176.232 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' ILE . 18.0 t70 -87.93 153.79 21.02 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.674 0.79 . . . . 0.0 111.281 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.67 -36.9 67.61 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.548 1.139 . . . . 0.0 112.365 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.35 -33.55 76.23 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.228 1.011 . . . . 0.0 111.844 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -96.87 -20.68 17.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.941 0.496 . . . . 0.0 110.918 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' ASP . 53.7 mt -74.76 124.51 32.61 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 174.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.5 t -146.13 -178.7 6.27 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.39 1.076 . . . . 0.0 108.474 165.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.41 74.06 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.401 0.619 . . . . 0.0 109.574 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -65.94 -12.28 53.63 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.837 178.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 91.6 m -72.9 -38.17 67.0 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.009 0.523 . . . . 0.0 110.489 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.524 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.6 m-85 -97.75 7.05 47.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.16 -47.85 77.44 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.376 0.422 . . . . 0.0 111.232 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.6 p -135.8 166.33 23.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.964 0.506 . . . . 0.0 110.868 173.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.9 tp -59.57 -38.05 80.11 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.072 174.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.1 -35.08 90.96 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.87 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -62.28 -53.08 60.32 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.012 0.525 . . . . 0.0 110.574 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.524 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -56.43 -43.48 79.46 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.508 0.505 . . . . 0.0 110.071 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.58 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.92 -48.13 82.57 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 124.589 1.18 . . . . 0.0 111.667 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 75' ' ' LEU . 2.4 mm? -66.96 -39.03 87.15 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.423 0.452 . . . . 0.0 110.94 -179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.495 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 24.5 m-85 -57.68 -54.72 43.66 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 176.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.44 -24.38 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.099 0.56 . . . . 0.0 112.051 -178.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.6 mm-40 -57.47 -56.01 27.42 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -60.19 -34.94 74.32 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.546 -174.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 30.9 mmmt -63.85 -56.71 13.33 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.344 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.456 HD22 ' HB2' ' A' ' 80' ' ' LYS . 3.1 mm? -84.22 -13.26 53.15 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -173.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -175.151 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.453 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.11 -36.22 9.76 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.035 0.934 . . . . 0.0 110.799 177.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -73.83 -17.57 61.05 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -169.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -51.99 -33.04 36.42 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 123.809 0.844 . . . . 0.0 112.581 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 -41.78 63.96 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.205 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.5 -28.95 65.36 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.917 0.487 . . . . 0.0 111.053 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.3 t -67.54 -50.55 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 122.994 0.517 . . . . 0.0 109.927 176.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -67.52 -28.62 67.97 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -60.26 -52.89 63.37 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 123.966 0.791 . . . . 0.0 109.749 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 49' ' ' LEU . 85.7 mt -62.92 -55.33 24.3 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 O-C-N 124.219 0.949 . . . . 0.0 111.492 -178.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.64 -34.65 78.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.742 0.417 . . . . 0.0 111.495 -175.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.478 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -78.91 -20.05 71.46 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-O 119.989 -0.34 . . . . 0.0 113.689 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.18 -48.01 25.63 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.033 0.533 . . . . 0.0 109.705 173.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.434 HG13 ' ND2' ' A' ' 44' ' ' ASN . 71.2 t -70.17 -49.77 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.466 1.106 . . . . 0.0 110.929 -176.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -78.21 -9.26 59.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.427 0.691 . . . . 0.0 111.255 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 66.1 t30 67.02 44.52 1.94 Allowed 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.543 1.137 . . . . 0.0 111.401 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 7.0 mp -72.29 -35.36 68.66 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.54 1.136 . . . . 0.0 110.68 173.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.24 -91.39 0.37 Allowed Glycine 0 C--N 1.346 1.122 0 CA-C-N 115.727 -0.67 . . . . 0.0 113.494 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -97.06 -21.02 17.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.787 0.835 . . . . 0.0 110.754 -177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -61.9 -34.25 75.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.392 0.677 . . . . 0.0 109.893 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 56.9 pttt -68.78 -29.84 68.3 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.224 0.61 . . . . 0.0 111.579 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -75.8 -40.74 54.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.164 0.586 . . . . 0.0 110.313 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -85.87 13.32 7.57 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.215 0.606 . . . . 0.0 112.05 -173.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.6 pp -113.36 163.09 15.29 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 122.011 -0.431 . . . . 0.0 111.206 172.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.9 p -122.81 -173.17 2.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.478 1.111 . . . . 0.0 110.251 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.03 65.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.316 0.646 . . . . 0.0 112.719 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -86.79 0.48 54.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.198 0.599 . . . . 0.0 112.602 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.436 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 97.2 p -73.26 125.68 28.34 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.588 0.355 . . . . 0.0 110.751 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.0 t -76.83 136.22 25.02 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.3 mt -108.6 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.532 0.333 . . . . 0.0 110.229 -175.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.52 117.02 5.64 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.45 -33.12 6.26 Favored Glycine 0 C--N 1.342 0.91 0 CA-C-N 115.855 -0.612 . . . . 0.0 113.151 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -90.54 -44.73 9.38 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.084 0.554 . . . . 0.0 110.983 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.501 HG12 ' HA ' ' A' ' 30' ' ' LEU . 33.7 mm -79.87 120.3 79.46 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -70.72 -13.77 32.54 Favored 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 122.847 2.364 . . . . 0.0 112.927 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.433 ' H ' HG22 ' A' ' 34' ' ' ILE . 8.5 mm-40 -94.11 -11.65 30.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.363 0.665 . . . . 0.0 111.091 -174.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -82.66 88.9 6.69 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' HG13 ' A' ' 42' ' ' VAL . 25.6 t70 -101.63 174.03 6.15 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.309 1.443 . . . . 0.0 108.932 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.588 ' O ' HG22 ' A' ' 42' ' ' VAL . 6.2 m -44.78 -65.33 0.54 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.796 1.238 . . . . 0.0 113.45 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.7 mmm -71.31 -16.68 62.46 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.606 -0.684 . . . . 0.0 111.654 -175.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.82 -33.85 71.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.319 0.648 . . . . 0.0 111.539 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 39' ' ' SER . 2.7 m -68.19 -39.4 81.14 Favored 'Isoleucine or valine' 0 C--N 1.371 1.507 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.9 t -64.85 -43.32 96.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.534 0.683 . . . . 0.0 109.904 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.434 ' ND2' HG13 ' A' ' 14' ' ' VAL . 56.3 t30 -66.02 -39.55 90.32 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.91 -1.496 . . . . 0.0 112.287 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 m -70.38 -39.59 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.036 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 42' ' ' VAL . 92.9 mt -61.4 -43.1 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 CA-C-N 118.257 0.48 . . . . 0.0 110.045 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.468 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 87.8 m -58.86 -45.13 90.84 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.108 175.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.432 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -63.07 -36.75 84.63 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.642 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 10' ' ' ILE . 3.5 mm? -60.35 -40.08 89.45 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.496 0.718 . . . . 0.0 110.103 175.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -57.98 -51.02 71.39 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.005 0.816 . . . . 0.0 110.481 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 47' ' ' THR . 7.5 mm-40 -58.62 -45.1 89.95 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 124.161 0.913 . . . . 0.0 111.473 -173.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.432 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 17.3 m-85 -81.74 -55.98 4.28 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -172.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -83.82 -18.19 38.47 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.0 58.88 2.58 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.339 1.056 . . . . 0.0 111.384 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -129.29 -171.82 2.59 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.431 172.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.1 m -127.8 111.72 13.96 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.628 166.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.1 t -69.47 112.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.358 0.949 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 173.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 32.9 t70 -77.54 151.71 34.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.179 0.592 . . . . 0.0 111.217 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -60.16 -32.94 71.52 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.604 0.761 . . . . 0.0 112.433 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -71.48 -31.85 67.6 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.296 0.638 . . . . 0.0 111.823 -173.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -85.65 -20.54 29.28 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.744 0.418 . . . . 0.0 110.887 -178.256 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 68.1 mt -73.07 124.06 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.26 0.624 . . . . 0.0 111.039 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 86.2 p -147.91 175.99 10.52 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.193 0.997 . . . . 0.0 109.448 166.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.14 78.84 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.636 0.731 . . . . 0.0 110.194 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -78.75 -8.63 58.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.114 -176.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -70.71 -37.63 73.57 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.628 ' HA ' HD21 ' A' ' 73' ' ' LEU . 55.2 m-85 -97.58 14.71 25.67 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.406 0.682 . . . . 0.0 112.72 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.69 -44.19 96.87 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 0.0 111.0 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 72' ' ' SER . 15.3 t -144.94 162.21 37.44 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.252 0.621 . . . . 0.0 110.428 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.77 -36.85 77.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.106 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.23 -33.86 87.31 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.96 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.407 ' H ' HG23 ' A' ' 69' ' ' THR . 74.4 m -64.67 -53.51 46.31 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 122.89 0.476 . . . . 0.0 110.662 177.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.628 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -59.01 -39.04 80.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.021 0.201 . . . . 0.0 110.477 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.564 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.03 -45.49 86.86 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 124.073 0.858 . . . . 0.0 110.383 176.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.76 -49.76 76.45 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.957 0.903 . . . . 0.0 110.893 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.448 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 72.9 m-85 -61.59 -48.14 82.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.596 0.358 . . . . 0.0 111.037 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 18.2 m -70.17 -26.79 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.512 0.325 . . . . 0.0 111.627 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 77.6 mm-40 -59.37 -51.86 68.11 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -58.69 -37.6 76.43 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 124.097 0.873 . . . . 0.0 112.052 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.0 mmmt -59.76 -54.96 40.17 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.254 0.55 . . . . 0.0 110.853 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.07 -14.01 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.895 -176.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.479 0.982 0 C-N-CA 122.678 0.391 . . . . 0.0 111.567 175.528 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -97.32 -41.77 8.09 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.135 0.969 . . . . 0.0 108.432 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -82.77 -3.91 57.24 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 113.691 -1.595 . . . . 0.0 112.734 -168.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -52.14 -34.32 44.12 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.941 0.897 . . . . 0.0 112.434 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.79 -43.21 63.04 Favored 'General case' 0 C--N 1.352 0.686 0 O-C-N 123.579 0.549 . . . . 0.0 110.355 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.62 -31.96 73.27 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.571 0.348 . . . . 0.0 111.124 176.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 85.1 t -68.53 -46.51 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 122.821 0.448 . . . . 0.0 110.461 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -70.79 -23.12 62.33 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.673 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -63.95 -50.19 69.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.479 HG21 HD22 ' A' ' 49' ' ' LEU . 88.7 mt -61.39 -48.3 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.673 178.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.05 -36.81 85.53 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.052 0.541 . . . . 0.0 110.341 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.532 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.45 -21.05 78.69 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.54 -0.755 . . . . 0.0 113.67 175.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -85.85 -46.01 11.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.952 0.901 . . . . 0.0 111.225 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.7 t -76.86 -55.73 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 123.752 0.821 . . . . 0.0 110.385 -175.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.533 HD11 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -82.93 -9.52 59.26 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.858 -176.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 68.28 63.52 0.36 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.735 1.214 . . . . 0.0 110.796 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.532 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.0 mp -82.01 -36.93 27.3 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.586 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.94 -89.66 0.06 OUTLIER Glycine 0 C--N 1.356 1.688 0 O-C-N 123.632 0.583 . . . . 0.0 113.795 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.94 -40.57 22.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.785 0.834 . . . . 0.0 110.317 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -28.17 63.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.917 1.287 . . . . 0.0 112.298 -170.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.7 4.11 8.45 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -92.16 -46.98 7.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.91 0.484 . . . . 0.0 109.775 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 t -70.48 -29.09 65.54 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.87 -172.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 4.1 pp -84.16 157.42 21.68 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.84 0.456 . . . . 0.0 111.431 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.2 p -137.42 -162.68 1.32 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.357 1.463 . . . . 0.0 108.533 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.83 -23.07 51.04 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.8 m -77.67 -12.02 59.93 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.635 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 35.9 t -62.03 124.74 21.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.742 0.817 . . . . 0.0 111.349 -177.097 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 67.6 t -74.0 153.97 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 70.9 mt -120.97 -60.11 1.68 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.435 HD23 HD12 ' A' ' 37' ' ' LEU . 33.5 mt -56.73 110.94 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.142 0.577 . . . . 0.0 110.63 169.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.42 -32.56 6.13 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.269 -0.878 . . . . 0.0 113.181 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -76.86 -60.29 2.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.529 0.331 . . . . 0.0 110.18 -179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.519 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 25.1 mm -78.33 116.98 63.46 Favored Pre-proline 0 CA--C 1.542 0.659 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.15 -6.55 18.09 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.324 2.016 . . . . 0.0 112.297 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -97.9 -10.29 24.85 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.69 0.796 . . . . 0.0 111.144 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.8 tm? -79.0 82.81 5.15 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -177.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.425 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 32.0 t70 -101.79 174.34 6.0 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.417 1.487 . . . . 0.0 109.74 176.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.612 ' O ' HG22 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -43.32 -60.52 1.67 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.209 1.404 . . . . 0.0 112.715 166.32 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.9 mmt -60.83 -32.49 71.87 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 121.135 0.493 . . . . 0.0 110.822 -178.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.533 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -68.74 -29.33 67.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.648 176.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 39' ' ' SER . 3.3 m -66.96 -37.68 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.875 0.761 . . . . 0.0 109.171 174.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 t -67.28 -44.64 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-O 121.543 0.687 . . . . 0.0 109.29 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -58.69 -49.5 77.36 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.059 -1.428 . . . . 0.0 112.532 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -70.35 -39.04 76.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.802 -175.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 89.2 mt -60.15 -46.26 94.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 88.4 m -57.0 -43.32 81.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 124.065 0.853 . . . . 0.0 110.611 174.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.406 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -69.6 -28.19 65.73 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.265 0.626 . . . . 0.0 112.15 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.531 HD12 HG11 ' A' ' 77' ' ' VAL . 3.6 mm? -61.95 -48.11 81.85 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -56.43 -42.83 78.72 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.005 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' THR . 47.3 mm-40 -60.17 -64.34 0.98 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.879 0.872 . . . . 0.0 111.571 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.447 ' HB2' HD11 ' A' ' 10' ' ' ILE . 48.3 m-85 -66.56 -45.78 78.24 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.838 0.711 . . . . 0.0 112.326 -171.014 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -83.94 -21.68 31.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 66.29 57.93 0.72 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.458 1.103 . . . . 0.0 111.025 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -140.58 179.48 6.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.157 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -126.44 114.89 18.77 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.1 p -72.48 145.77 11.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 124.944 1.298 . . . . 0.0 110.918 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.467 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.1 t70 -87.01 142.22 28.09 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 174.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.4 -36.79 74.29 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -176.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -70.19 -15.98 63.01 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.9 pt-20 -86.91 -33.43 19.72 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.647 0.379 . . . . 0.0 110.34 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 42.9 mt -78.99 129.01 38.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.006 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 t -141.76 -177.68 5.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.957 1.303 . . . . 0.0 107.961 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.73 -27.41 67.6 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -64.84 -13.41 55.99 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.371 1.068 . . . . 0.0 111.659 174.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 89.1 m -76.03 -50.25 15.31 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 170.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.459 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 97.5 m-85 -84.2 8.76 14.71 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.2 pt-20 -60.04 -42.97 95.58 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 122.47 0.308 . . . . 0.0 110.907 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.52 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.0 t -150.82 162.53 40.56 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.418 0.628 . . . . 0.0 112.009 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.7 -37.78 82.82 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.506 -1.224 . . . . 0.0 110.754 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.94 -32.46 84.11 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.86 -177.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 54.9 m -70.17 -51.94 27.3 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.265 177.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.41 -46.62 62.98 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.234 0.54 . . . . 0.0 111.105 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -63.68 -39.18 93.69 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.203 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -47.34 83.02 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.953 0.901 . . . . 0.0 109.628 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.464 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 59.1 m-85 -61.78 -43.51 98.7 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.207 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.531 HG11 HD12 ' A' ' 49' ' ' LEU . 29.9 m -72.87 -23.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-O 119.007 -0.521 . . . . 0.0 112.228 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 65.0 mm-40 -56.19 -51.17 69.0 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 167.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 76' ' ' PHE . 90.6 m-70 -54.33 -49.56 69.44 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.286 0.991 . . . . 0.0 111.832 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 28.1 mmmt -68.18 -43.71 77.53 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -171.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.25 -14.9 52.24 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.699 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.486 1.37 0 C-N-CA 123.173 0.589 . . . . 0.0 112.55 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 tpt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -60.76 -36.49 79.07 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.801 0.84 . . . . 0.0 113.026 -166.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' ' 7' ' ' VAL . 2.6 m-70 -73.23 -11.56 60.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 118.187 -0.911 . . . . 0.0 112.282 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.24 -30.83 51.67 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 118.395 0.543 . . . . 0.0 110.879 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.19 -53.14 53.96 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.549 1.14 . . . . 0.0 110.528 -178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.435 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.26 -35.49 79.63 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.393 -0.822 . . . . 0.0 111.252 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -65.82 -51.74 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 O-C-N 123.433 0.458 . . . . 0.0 110.048 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 11' ' ' LEU . 40.9 ptt180 -68.8 -27.0 65.48 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.041 0.536 . . . . 0.0 110.29 -176.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.6 -48.98 79.36 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 123.96 0.788 . . . . 0.0 109.657 173.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.2 mt -63.15 -47.41 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 124.274 0.984 . . . . 0.0 110.932 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 8' ' ' ARG . 52.2 mt -60.3 -42.79 96.28 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.492 0.717 . . . . 0.0 111.025 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.458 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -77.33 -18.78 77.66 Favored Glycine 0 C--N 1.339 0.72 0 CA-C-N 115.742 -0.663 . . . . 0.0 113.202 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.1 -43.31 43.9 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.225 0.512 . . . . 0.0 109.693 174.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 10' ' ' ILE . 88.1 t -71.8 -60.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -83.05 -3.8 57.65 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.621 -170.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 66.61 55.97 0.76 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.792 1.237 . . . . 0.0 111.733 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -84.11 -29.25 26.91 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.964 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.25 -99.54 1.32 Allowed Glycine 0 C--N 1.35 1.343 0 O-C-N 123.542 0.526 . . . . 0.0 112.52 177.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.15 -23.05 18.09 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.826 0.85 . . . . 0.0 110.389 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.518 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.24 -30.86 71.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 0.0 110.421 -175.835 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 60.0 pttt -62.8 -33.61 75.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.309 0.644 . . . . 0.0 111.806 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -88.71 -18.54 27.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.024 0.529 . . . . 0.0 111.315 -172.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -94.52 -1.53 53.25 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.049 0.54 . . . . 0.0 111.244 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.518 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -99.0 148.12 24.32 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 173.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.5 p -118.39 -171.95 2.18 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.528 0.731 . . . . 0.0 111.173 -170.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.06 -23.47 67.46 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.114 0.565 . . . . 0.0 112.458 178.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.1 t -88.01 -17.05 32.03 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.328 0.651 . . . . 0.0 111.753 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 24' ' ' LEU . 79.0 p -77.33 128.06 33.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.44 0.296 . . . . 0.0 110.214 -178.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.4 t -81.38 143.04 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 124.571 1.149 . . . . 0.0 109.772 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.569 ' HA ' HG12 ' A' ' 34' ' ' ILE . 64.4 mt -102.33 -67.81 0.86 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.397 0.679 . . . . 0.0 110.236 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.601 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.2 tt -57.46 115.74 2.92 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.88 0.872 . . . . 0.0 111.442 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.59 -22.54 7.5 Favored Glycine 0 C--N 1.353 1.479 0 CA-C-N 115.747 -0.661 . . . . 0.0 114.272 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -90.1 -47.18 7.98 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.709 0.804 . . . . 0.0 110.687 -176.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.569 HG12 ' HA ' ' A' ' 30' ' ' LEU . 43.8 mm -75.63 122.16 86.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.07 -8.55 23.92 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.797 2.331 . . . . 0.0 113.288 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.423 ' H ' HG22 ' A' ' 34' ' ' ILE . 58.7 mm-40 -90.49 -28.85 18.29 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 173.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.601 HD12 ' HA ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -74.53 94.26 2.6 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 32.1 t70 -125.74 -166.21 1.53 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 125.246 1.418 . . . . 0.0 107.705 171.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 42' ' ' VAL . 12.9 m -41.82 -69.39 0.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.605 1.562 . . . . 0.0 114.58 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 mmt -70.74 -23.92 62.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.242 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 45' ' ' VAL . . . -60.71 -41.77 95.88 Favored 'General case' 0 C--N 1.345 0.392 0 O-C-N 123.932 0.77 . . . . 0.0 111.405 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -63.13 -42.38 96.33 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.1 t -63.81 -45.6 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.729 0.776 . . . . 0.0 110.354 -176.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -58.23 -47.96 81.88 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.502 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.458 ' O ' HD23 ' A' ' 49' ' ' LEU . 24.8 m -76.01 -25.29 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 119.069 -0.491 . . . . 0.0 112.017 -175.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 42' ' ' VAL . 90.7 mt -62.74 -55.73 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 171.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.7 m -54.98 -46.91 75.14 Favored 'General case' 0 C--N 1.356 0.888 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.795 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.97 89.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.991 0.917 . . . . 0.0 111.621 -177.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -53.89 -43.55 69.75 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.293 0.637 . . . . 0.0 110.071 175.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.478 ' HG2' ' H ' ' A' ' 57' ' ' VAL . 42.9 mt-10 -61.8 -45.4 94.0 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.309 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' THR . 44.1 mm-40 -63.39 -55.18 26.51 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.177 0.591 . . . . 0.0 111.477 -176.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -69.0 -42.06 76.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.147 0.579 . . . . 0.0 112.439 -174.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -82.65 -11.31 58.46 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 66.43 38.02 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.654 1.182 . . . . 0.0 111.69 174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.3 -168.7 1.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.716 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.5 t -133.51 116.99 16.62 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 167.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.478 ' H ' ' HG2' ' A' ' 50' ' ' GLU . 48.0 t -69.75 113.8 6.17 Favored 'Isoleucine or valine' 0 C--N 1.351 0.636 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 173.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.512 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.0 t70 -70.3 148.85 48.02 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.671 0.789 . . . . 0.0 110.784 -173.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -56.97 -41.49 78.44 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.336 0.654 . . . . 0.0 112.491 -176.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.63 -27.29 67.57 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.51 0.724 . . . . 0.0 112.308 -174.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -95.79 -5.42 41.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.241 0.616 . . . . 0.0 111.129 -177.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 58' ' ' ASP . 58.2 mt -83.67 106.82 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 122.735 0.414 . . . . 0.0 110.02 175.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -128.28 173.98 9.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.035 0.934 . . . . 0.0 109.546 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.91 -31.27 70.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.079 0.552 . . . . 0.0 110.149 169.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -67.11 -18.97 65.55 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.396 175.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.5 m -73.68 -37.28 65.28 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.557 ' HA ' HD21 ' A' ' 73' ' ' LEU . 68.1 m-85 -107.83 15.76 24.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.519 0.728 . . . . 0.0 112.196 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.78 -42.69 94.89 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.371 0.419 . . . . 0.0 110.477 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.0 t -146.85 166.18 27.47 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.034 0.534 . . . . 0.0 110.606 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 24' ' ' LEU . 61.9 tp -62.47 -35.48 79.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.071 0.549 . . . . 0.0 110.681 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.24 -32.14 79.6 Favored Glycine 0 C--N 1.351 1.402 0 O-C-N 123.688 0.618 . . . . 0.0 112.72 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.4 m -68.4 -52.65 30.61 Favored 'General case' 0 C--N 1.347 0.5 0 C-N-CA 123.161 0.585 . . . . 0.0 110.469 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.557 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.1 mm? -61.57 -42.24 98.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 117.812 0.278 . . . . 0.0 111.497 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.547 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.46 -46.74 80.22 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.071 0.857 . . . . 0.0 110.248 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -49.66 76.83 Favored 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 124.208 1.003 . . . . 0.0 110.599 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.47 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 18.1 m-85 -60.07 -50.47 73.59 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.52 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.71 -28.89 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.652 0.381 . . . . 0.0 111.695 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 50.2 mm-40 -60.27 -46.79 88.61 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 170.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.27 -29.4 70.49 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.927 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -70.32 -56.61 6.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.101 0.56 . . . . 0.0 111.908 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.21 -14.02 62.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.547 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 122.259 0.224 . . . . 0.0 110.614 170.759 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.3 -37.8 8.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.341 1.056 . . . . 0.0 110.841 176.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.442 ' O ' HG23 ' A' ' 7' ' ' VAL . 79.4 m-70 -79.93 -16.5 55.16 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -169.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 2.4 pt? -53.5 -28.67 32.21 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.499 0.59 . . . . 0.0 111.622 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -57.81 -56.54 20.69 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.496 1.518 . . . . 0.0 110.409 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.414 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.41 -28.3 64.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.802 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 3' ' ' HIS . 95.2 t -68.29 -50.6 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.075 0 C-N-CA 122.474 0.31 . . . . 0.0 110.924 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 19.0 ptt85 -70.52 -24.04 62.75 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.415 0.286 . . . . 0.0 110.56 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.14 -48.47 81.46 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.795 170.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 6' ' ' ALA . 81.3 mt -60.48 -57.73 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.936 0.894 . . . . 0.0 111.74 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.46 ' HG ' HG11 ' A' ' 45' ' ' VAL . 9.2 mp -64.31 -34.92 79.25 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 123.083 0.239 . . . . 0.0 110.999 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.567 ' HA3' ' HD2' ' A' ' 21' ' ' LYS . . . -66.51 -34.39 87.55 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-N 116.239 -0.437 . . . . 0.0 113.376 174.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -72.06 -52.05 18.7 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.577 0.751 . . . . 0.0 109.893 -178.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.4 t -66.63 -53.17 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.014 0.926 . . . . 0.0 110.655 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.436 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.6 mm? -87.91 -5.24 58.66 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 65.1 56.02 1.07 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.996 0.903 . . . . 0.0 110.925 174.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.521 HD23 ' HA2' ' A' ' 12' ' ' GLY . 4.3 mm? -70.48 -31.7 68.93 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 178.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 73.89 -98.58 0.98 Allowed Glycine 0 C--N 1.342 0.877 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.334 -178.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.69 -11.74 19.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.953 0.901 . . . . 0.0 111.152 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -72.26 -29.29 63.77 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -178.927 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HD2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -69.15 -10.76 59.23 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 173.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -89.35 -36.94 15.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.116 0.566 . . . . 0.0 110.722 177.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.2 t -76.88 -21.61 54.69 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.647 0.379 . . . . 0.0 111.217 -173.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -86.99 146.84 25.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.8 p -123.72 -169.47 1.95 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.463 1.105 . . . . 0.0 109.218 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.78 72.87 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.611 0.364 . . . . 0.0 110.786 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.8 m -80.78 2.56 25.71 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.627 0.771 . . . . 0.0 112.44 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -95.29 145.57 24.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.84 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -77.95 156.87 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.303 1.041 . . . . 0.0 109.139 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 70' ' ' LEU . 82.5 mt -119.87 -62.98 1.42 Allowed 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.902 -0.499 . . . . 0.0 110.234 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 37' ' ' LEU . 93.8 mt -55.34 112.3 1.07 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.307 0.643 . . . . 0.0 110.984 172.512 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.49 -33.48 4.95 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.017 -0.538 . . . . 0.0 113.328 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.43 -41.31 69.66 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.165 0.586 . . . . 0.0 110.174 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.505 HD12 HD11 ' A' ' 17' ' ' LEU . 20.3 mm -90.35 119.22 69.19 Favored Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 174.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.86 -12.28 32.41 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.685 2.256 . . . . 0.0 112.79 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.406 ' H ' HG22 ' A' ' 34' ' ' ILE . 36.4 mm-40 -93.15 -23.87 18.44 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.169 0.588 . . . . 0.0 111.384 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 31' ' ' LEU . 1.2 tm? -79.46 82.32 5.6 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -176.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.475 ' O ' HG13 ' A' ' 42' ' ' VAL . 17.9 t70 -115.68 -155.34 0.57 Allowed 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 125.081 1.352 . . . . 0.0 108.739 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.606 ' O ' HG22 ' A' ' 42' ' ' VAL . 36.0 t -54.26 -71.7 0.07 Allowed 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.078 1.351 . . . . 0.0 113.991 -169.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.67 -24.08 67.64 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.649 -0.657 . . . . 0.0 112.016 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.453 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -67.87 -37.97 82.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.45 0.7 . . . . 0.0 111.678 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 39' ' ' SER . 6.3 m -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 C--N 1.369 1.456 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 174.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 t -70.33 -40.49 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.829 -176.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -63.81 -41.22 97.93 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.233 1.013 . . . . 0.0 112.076 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.46 HG11 ' HG ' ' A' ' 11' ' ' LEU . 21.7 m -74.37 -33.06 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.355 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.454 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.8 mt -59.43 -47.28 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 41.5 m -59.18 -43.48 92.16 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.109 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -32.26 73.54 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.679 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.8 -45.58 91.89 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 2.4 mm-40 -57.39 -49.34 76.5 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.617 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 47' ' ' THR . 17.6 mm-40 -67.02 -52.45 42.24 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.465 0.706 . . . . 0.0 111.995 -174.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.66 -60.66 3.33 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.7 0.8 . . . . 0.0 111.718 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -78.02 -17.77 56.68 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.232 0.332 . . . . 0.0 111.43 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 65.6 62.43 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.768 1.227 . . . . 0.0 109.82 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.38 -166.61 2.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.656 176.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.5 m -133.01 113.09 12.4 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 123.204 0.602 . . . . 0.0 109.974 167.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 70.7 t -73.17 108.84 4.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.713 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 167.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 22.9 t70 -63.08 148.91 46.48 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.509 -171.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.3 -32.09 71.94 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.895 0.478 . . . . 0.0 112.0 -175.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -70.19 -27.92 64.89 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.535 0.734 . . . . 0.0 111.533 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.1 pt-20 -92.68 -12.48 31.39 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.183 0.193 . . . . 0.0 110.973 -178.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 58' ' ' ASP . 45.5 mt -84.91 106.94 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 122.92 0.488 . . . . 0.0 110.149 175.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.2 p -130.0 179.68 5.73 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.361 1.064 . . . . 0.0 108.703 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.37 -34.5 78.31 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.014 174.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -67.92 -12.71 61.23 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.314 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -70.65 -40.09 73.25 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.829 0.451 . . . . 0.0 110.603 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.505 ' HA ' HD21 ' A' ' 73' ' ' LEU . 52.5 m-85 -107.61 18.26 21.66 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 69' ' ' THR . 11.1 pt-20 -61.73 -38.35 87.58 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 72' ' ' SER . 8.3 t -146.24 160.6 41.77 Favored 'General case' 0 C--O 1.25 1.103 0 C-N-CA 123.315 0.646 . . . . 0.0 110.729 175.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.41 ' HA ' HD11 ' A' ' 30' ' ' LEU . 12.5 tp -63.6 -29.62 70.84 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.67 -38.22 95.37 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.992 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.509 ' H ' HG23 ' A' ' 69' ' ' THR . 64.4 m -58.67 -51.53 69.52 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -58.37 -45.48 88.19 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 123.667 0.605 . . . . 0.0 111.194 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.592 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -55.45 -45.45 76.86 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.708 1.255 . . . . 0.0 110.143 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.47 -43.57 85.09 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.724 0.64 . . . . 0.0 111.548 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 21.3 m-85 -54.32 -55.78 25.04 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.5 m -73.39 -24.79 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.148 0.979 . . . . 0.0 112.301 -174.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.0 mm-40 -55.64 -54.95 37.88 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 168.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -69.08 -32.08 71.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.765 -171.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.71 -54.96 41.0 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.23 0.612 . . . . 0.0 110.721 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.401 HD22 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -80.73 -13.55 58.89 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.777 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.478 0.929 0 C-N-CA 122.362 0.265 . . . . 0.0 110.413 170.957 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -94.51 -53.96 3.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 122.05 0.929 . . . . 0.0 108.741 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 7' ' ' VAL . 97.6 m-70 -70.8 -17.71 62.76 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.0 -1.909 . . . . 0.0 113.419 -164.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -50.09 -34.35 21.55 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -72.3 -42.37 65.55 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 122.511 0.324 . . . . 0.0 110.617 -176.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.83 -33.88 76.87 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.214 0.605 . . . . 0.0 111.07 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 3' ' ' HIS . 83.9 t -66.66 -50.79 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.153 0.581 . . . . 0.0 109.767 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.9 ptt180 -68.6 -26.83 65.57 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.711 0.404 . . . . 0.0 110.634 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.404 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 32.0 t30 -61.64 -50.01 74.24 Favored 'General case' 0 C--O 1.25 1.09 0 C-N-CA 123.996 0.919 . . . . 0.0 109.758 175.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.19 -50.06 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.719 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.3 mt -58.86 -39.89 82.7 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.433 0.693 . . . . 0.0 111.475 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.452 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -71.98 -28.08 69.29 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-O 119.851 -0.416 . . . . 0.0 113.337 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -75.41 -39.51 58.88 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 117.031 0.415 . . . . 0.0 110.686 175.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.2 t -75.18 -54.29 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.005 0.522 . . . . 0.0 110.493 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.542 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.4 mm? -84.78 1.44 46.7 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.172 0.589 . . . . 0.0 112.072 -176.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 65.82 46.61 2.26 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 122.22 1.009 . . . . 0.0 111.245 170.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 mp -77.52 -34.95 53.88 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.873 172.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.49 -91.24 0.25 Allowed Glycine 0 C--N 1.352 1.455 0 O-C-N 123.912 0.757 . . . . 0.0 113.072 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -92.5 -28.92 16.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.984 0.914 . . . . 0.0 110.657 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.2 OUTLIER -65.54 -24.64 67.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.692 0.797 . . . . 0.0 111.435 -173.492 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.452 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 61.0 pttt -65.18 -27.03 68.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.847 0.459 . . . . 0.0 111.817 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.8 t-80 -92.01 -22.96 19.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.774 0.43 . . . . 0.0 110.877 -175.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.473 HG22 ' HA ' ' A' ' 20' ' ' ARG . 7.2 t -86.15 -1.05 57.06 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.359 0.264 . . . . 0.0 111.187 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -103.64 156.43 17.8 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.956 0.408 . . . . 0.0 110.146 172.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.3 p -121.51 -172.34 2.4 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.216 1.006 . . . . 0.0 110.178 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.3 81.23 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 t -75.18 -3.73 34.7 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.002 0.521 . . . . 0.0 112.194 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.1 t -67.68 137.1 55.29 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.001 0.521 . . . . 0.0 110.498 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -86.7 150.69 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.918 0.887 . . . . 0.0 109.863 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.3 mt -109.02 -66.93 1.01 Allowed 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.5 mt -54.41 121.39 8.21 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.842 0.857 . . . . 0.0 111.264 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.76 -28.56 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 119.533 -0.593 . . . . 0.0 113.809 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -77.71 -66.21 0.87 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.498 0.649 . . . . 0.0 110.021 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.16 119.27 76.81 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.192 -175.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.99 -15.52 36.26 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 122.315 2.01 . . . . 0.0 111.899 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -88.04 -29.26 20.81 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.944 0.898 . . . . 0.0 110.152 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.8 100.57 3.48 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.441 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 27.1 t70 -132.52 -156.83 0.78 Allowed 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 171.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.716 ' O ' HG22 ' A' ' 42' ' ' VAL . 58.0 p -67.46 -54.52 19.5 Favored 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -167.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 97.0 mmm -61.55 -27.52 68.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.691 -1.255 . . . . 0.0 111.263 177.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.542 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -68.24 -33.73 74.93 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.795 175.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.716 HG22 ' O ' ' A' ' 39' ' ' SER . 5.9 m -64.68 -37.62 80.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 118.791 0.723 . . . . 0.0 109.645 175.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.49 -48.15 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 121.499 0.666 . . . . 0.0 109.956 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -60.41 -45.84 92.15 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 113.799 -1.546 . . . . 0.0 112.634 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' HD23 ' A' ' 49' ' ' LEU . 32.6 m -71.05 -31.94 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 119.031 -0.509 . . . . 0.0 111.575 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.424 HD13 HD13 ' A' ' 62' ' ' ILE . 82.3 mt -63.48 -50.57 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -50.91 -48.76 60.52 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.508 1.13 . . . . 0.0 110.922 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.44 -46.82 84.5 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.798 -178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.3 mm? -55.2 -45.23 75.86 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.576 0.75 . . . . 0.0 110.366 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.5 -40.1 96.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.823 0.849 . . . . 0.0 112.05 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -65.48 -52.52 52.27 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.43 0.692 . . . . 0.0 112.139 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.49 -49.48 40.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -176.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -75.45 -16.76 60.3 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.834 0.454 . . . . 0.0 111.755 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.49 46.76 3.2 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.432 1.11 . . . . 0.0 110.273 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.93 -170.78 2.58 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.483 175.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.9 t -126.08 117.14 22.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 166.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.12 108.54 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.76 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.592 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.2 t70 -72.8 144.23 47.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.463 0.705 . . . . 0.0 111.286 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.55 -38.7 64.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.875 0.87 . . . . 0.0 112.626 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -71.6 -21.19 61.89 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.218 0.607 . . . . 0.0 111.99 -172.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 10.8 pt-20 -94.6 -17.39 22.36 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.255 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.424 HD13 HD13 ' A' ' 46' ' ' ILE . 76.7 mt -81.05 109.39 15.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 123.185 0.594 . . . . 0.0 110.078 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.3 t -130.11 170.4 14.08 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 164.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.91 76.06 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -63.95 -18.97 64.78 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.498 0.719 . . . . 0.0 112.243 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.6 m -64.47 -38.81 92.3 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.283 0.633 . . . . 0.0 110.097 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.571 ' HA ' HD21 ' A' ' 73' ' ' LEU . 77.3 m-85 -96.17 19.45 11.77 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.34 1.056 . . . . 0.0 112.623 -177.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.64 -48.9 77.36 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 123.091 0.244 . . . . 0.0 110.447 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.6 p -142.05 162.59 35.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.816 0.847 . . . . 0.0 110.395 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 60.9 tp -56.29 -40.32 74.12 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.017 0.927 . . . . 0.0 111.386 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.74 -35.45 92.03 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 114.513 -1.222 . . . . 0.0 112.034 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 m -62.2 -51.03 69.43 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 122.959 0.504 . . . . 0.0 110.483 177.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.571 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.07 -42.56 80.84 Favored 'General case' 0 C--N 1.365 1.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.887 176.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.571 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.74 -43.25 85.24 Favored 'General case' 0 C--O 1.21 -1.018 0 O-C-N 124.686 1.241 . . . . 0.0 110.973 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.87 -51.47 68.07 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.864 0.727 . . . . 0.0 110.791 178.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.529 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 68.5 m-85 -55.69 -49.7 72.25 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 123.668 0.605 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.2 m -72.64 -24.86 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.163 0.585 . . . . 0.0 112.018 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.5 mm-40 -56.82 -53.73 54.53 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 169.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -58.69 -43.24 89.93 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.487 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -53.52 -59.02 5.13 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 124.118 0.886 . . . . 0.0 112.157 -177.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -79.22 -13.89 59.41 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.121 -174.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 N--CA 1.477 0.908 0 C-N-CA 122.751 0.42 . . . . 0.0 111.478 174.86 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -36.71 -47.36 0.66 Allowed 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 115.903 1.816 . . . . 0.0 115.903 -162.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.412 ' O ' HG23 ' A' ' 7' ' ' VAL . 39.1 m-70 -68.48 -25.98 65.25 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.47 -30.78 8.69 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 123.925 0.89 . . . . 0.0 112.776 -179.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.86 -50.58 66.05 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 124.315 1.046 . . . . 0.0 110.797 -176.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.22 -25.7 55.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.882 -179.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 3' ' ' HIS . 70.5 t -67.29 -49.59 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.503 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -71.55 -24.46 61.94 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.096 0.558 . . . . 0.0 110.3 -178.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -60.95 -50.26 74.12 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.252 0.621 . . . . 0.0 109.666 171.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.35 -46.86 95.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.481 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.2 mt -62.71 -42.51 99.68 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.01 0.524 . . . . 0.0 110.494 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.586 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -68.17 -22.15 74.23 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.436 -0.802 . . . . 0.0 113.239 178.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -84.3 -47.44 10.75 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.372 0.669 . . . . 0.0 111.504 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.16 -58.24 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.455 0.702 . . . . 0.0 110.447 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.5 mm? -80.76 -14.02 58.46 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.792 0.437 . . . . 0.0 110.605 -175.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 67.16 64.47 0.44 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.338 1.055 . . . . 0.0 109.714 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.492 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 3.6 mm? -79.33 -27.04 42.07 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.386 -0.825 . . . . 0.0 108.904 164.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 64.43 -100.82 0.45 Allowed Glycine 0 C--N 1.354 1.55 0 O-C-N 123.664 0.602 . . . . 0.0 113.636 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -89.09 -23.63 22.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.955 0.902 . . . . 0.0 110.795 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' HD12 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -70.81 -22.6 62.33 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.573 0.749 . . . . 0.0 111.003 -176.41 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 22.8 pttm -63.99 -23.6 67.4 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.138 -0.351 . . . . 0.0 110.927 173.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -80.69 -23.83 39.3 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.364 0.666 . . . . 0.0 111.485 -178.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.4 t -94.43 -15.72 24.03 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -91.27 149.48 21.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 81.4 p -118.4 -169.89 1.79 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.361 1.064 . . . . 0.0 109.36 -177.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.17 63.8 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 122.927 0.491 . . . . 0.0 112.195 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -74.16 -16.53 60.99 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.978 0.911 . . . . 0.0 112.452 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.6 p -66.51 123.11 19.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.03 0.532 . . . . 0.0 111.043 -176.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.5 t -75.98 148.67 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 175.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.411 ' HA ' HG12 ' A' ' 34' ' ' ILE . 74.5 mt -113.83 -67.65 0.98 Allowed 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.076 -0.39 . . . . 0.0 110.145 -178.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.89 111.37 1.14 Allowed 'General case' 0 C--N 1.35 0.625 0 C-N-CA 122.98 0.512 . . . . 0.0 110.926 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 -34.62 4.98 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-N 115.216 -0.902 . . . . 0.0 113.191 178.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -80.76 -45.57 16.82 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.266 0.626 . . . . 0.0 110.856 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 30' ' ' LEU . 23.4 mm -90.67 116.15 65.77 Favored Pre-proline 0 C--O 1.243 0.734 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 177.181 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.15 -4.86 14.71 Favored 'Trans proline' 0 C--N 1.368 1.583 0 C-N-CA 122.446 2.097 . . . . 0.0 112.401 -177.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 14.4 mm-40 -89.26 -18.42 27.05 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.397 0.679 . . . . 0.0 110.151 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 56.9 tp -83.63 87.64 7.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.597 0.713 . . . . 0.0 109.189 -177.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.407 ' N ' ' HB3' ' A' ' 41' ' ' ALA . 29.6 t70 -85.53 173.14 10.42 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.94 1.296 . . . . 0.0 110.287 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.665 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.9 t -49.32 -65.21 0.61 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 125.337 1.455 . . . . 0.0 112.231 169.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.0 mmt -60.88 -23.76 65.44 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.306 -0.871 . . . . 0.0 111.981 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.407 ' HB3' ' N ' ' A' ' 38' ' ' ASP . . . -73.14 -28.39 62.22 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.665 HG22 ' O ' ' A' ' 39' ' ' SER . 4.3 m -66.16 -37.53 79.95 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -67.0 -39.45 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.85 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -59.66 -47.4 85.76 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.756 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.48 -30.46 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.753 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.5 HD13 HD13 ' A' ' 62' ' ' ILE . 97.0 mt -64.5 -48.19 86.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.7 m -58.74 -44.71 90.57 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.267 0.979 . . . . 0.0 110.532 177.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.97 89.35 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.129 178.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -58.2 -45.77 87.0 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.146 0.578 . . . . 0.0 109.635 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.5 mm-40 -51.5 -49.25 62.24 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 124.325 1.015 . . . . 0.0 110.037 175.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 47' ' ' THR . 25.4 mm-40 -62.1 -66.32 0.56 Allowed 'General case' 0 C--N 1.353 0.727 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.695 -173.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -70.6 -37.14 73.85 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -168.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -88.33 -14.84 37.21 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.325 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 63.79 46.12 4.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.28 1.032 . . . . 0.0 111.548 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.515 ' CZ ' HG22 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -141.52 -171.94 3.42 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.316 -179.46 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 t -126.0 130.91 52.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 122.918 0.487 . . . . 0.0 110.149 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.515 HG22 ' CZ ' ' A' ' 55' ' ' PHE . 2.6 t -86.31 118.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 172.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 27.0 t70 -76.08 144.8 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.4 0.68 . . . . 0.0 111.838 -170.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -55.22 -40.06 70.4 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.131 0.973 . . . . 0.0 113.377 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.34 -32.32 68.41 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.276 0.631 . . . . 0.0 112.068 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.4 pt-20 -85.96 -23.62 26.85 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.5 HD13 HD13 ' A' ' 46' ' ' ILE . 68.9 mt -72.25 110.12 5.05 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t -139.76 175.82 9.25 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 171.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.9 71.61 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -63.97 -21.4 66.47 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.143 0.977 . . . . 0.0 112.26 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.451 HG22 HD13 ' A' ' 73' ' ' LEU . 20.7 m -81.97 -41.13 21.21 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.189 0.595 . . . . 0.0 110.17 175.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.508 ' HA ' HD21 ' A' ' 73' ' ' LEU . 61.9 m-85 -101.02 7.25 43.57 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.573 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -62.33 -41.24 98.39 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.948 0.499 . . . . 0.0 111.426 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.573 HG22 ' HG3' ' A' ' 68' ' ' GLU . 7.1 t -148.6 154.76 40.17 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.518 0.727 . . . . 0.0 110.052 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.2 tp -56.21 -33.02 64.94 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.201 1.0 . . . . 0.0 111.604 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.18 -43.25 99.64 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.531 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -61.88 -44.14 97.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.968 0.507 . . . . 0.0 111.05 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.5 mm? -59.01 -47.57 84.71 Favored 'General case' 0 C--N 1.363 1.166 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.612 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -53.41 -52.86 58.01 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 124.624 1.203 . . . . 0.0 110.031 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.1 -45.15 93.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.11 0.964 . . . . 0.0 112.224 -174.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.462 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.7 m-85 -60.44 -49.89 75.77 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.256 0.222 . . . . 0.0 110.867 177.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.2 m -71.39 -23.84 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 122.521 0.329 . . . . 0.0 111.132 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 81.8 mm-40 -56.86 -50.48 72.33 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -57.79 -47.96 81.07 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.108 0.88 . . . . 0.0 110.733 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.6 mmmt -62.7 -55.01 30.71 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.209 -172.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.69 -12.24 60.95 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.511 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 CA--C 1.551 1.019 0 C-N-CA 123.057 0.543 . . . . 0.0 111.49 171.292 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mpp? . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.767 0.318 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -92.25 -45.59 8.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.289 1.042 . . . . 0.0 108.216 176.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -79.48 -9.84 59.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 113.498 -1.683 . . . . 0.0 113.597 -164.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -53.13 -30.27 35.86 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.632 0.651 . . . . 0.0 112.341 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.68 -51.67 61.26 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.048 0.939 . . . . 0.0 110.793 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.56 -35.55 75.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.429 -177.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.2 t -63.91 -50.34 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 122.923 0.489 . . . . 0.0 109.814 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -67.88 -28.65 67.7 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.773 0.429 . . . . 0.0 110.461 -177.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -61.89 -48.77 79.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.656 0.782 . . . . 0.0 109.881 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.5 mt -59.13 -55.24 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.191 0.996 . . . . 0.0 110.995 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.37 -45.2 88.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.116 -174.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.48 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.37 -19.48 79.83 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 116.265 -0.425 . . . . 0.0 113.536 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.8 -38.33 58.29 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.983 0.391 . . . . 0.0 110.104 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -75.29 -56.43 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.529 0.732 . . . . 0.0 110.37 -178.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.431 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.4 mm? -81.75 2.19 31.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.513 0.725 . . . . 0.0 112.031 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.6 34.49 2.72 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.434 1.093 . . . . 0.0 111.897 168.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HG ' ' HD2' ' A' ' 20' ' ' ARG . 6.0 mp -68.12 -33.71 75.01 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.872 0.869 . . . . 0.0 111.256 177.444 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.26 -95.13 0.57 Allowed Glycine 0 C--N 1.351 1.411 0 O-C-N 123.463 0.477 . . . . 0.0 113.095 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -96.33 -24.7 16.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.0 0.92 . . . . 0.0 110.434 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.1 OUTLIER -61.68 -28.74 69.61 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.424 0.69 . . . . 0.0 111.423 -176.103 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.2 pttt -65.98 -26.25 67.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.376 0.67 . . . . 0.0 112.224 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -96.73 -20.93 17.88 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.272 0.629 . . . . 0.0 110.998 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.526 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.1 t -87.2 4.96 40.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.769 0.427 . . . . 0.0 111.38 179.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -107.69 169.87 8.33 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.376 0.67 . . . . 0.0 109.684 171.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.5 p -127.18 -171.38 2.4 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 0.0 109.56 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.74 -31.54 70.86 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.907 0.483 . . . . 0.0 112.016 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -73.4 -4.93 36.58 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -71.6 129.74 39.46 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.03 0.532 . . . . 0.0 110.835 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.405 ' HB ' ' HB2' ' A' ' 33' ' ' ASN . 59.2 t -73.63 155.33 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 124.409 1.083 . . . . 0.0 108.72 171.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 27.3 mt -124.59 -67.13 0.93 Allowed 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 68' ' ' GLU . 5.2 tt -64.96 110.86 2.6 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 172.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.98 -32.13 7.83 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 123.477 0.486 . . . . 0.0 112.73 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.405 ' HB2' ' HB ' ' A' ' 29' ' ' VAL . 53.7 t-20 -84.31 -65.41 1.01 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.78 0.832 . . . . 0.0 110.434 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.424 HG22 ' H ' ' A' ' 36' ' ' GLU . 27.4 mm -71.86 118.12 63.96 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.527 -171.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.92 -4.13 14.85 Favored 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 122.559 2.173 . . . . 0.0 112.442 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 37.7 mm-40 -99.32 -10.24 22.56 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.318 1.047 . . . . 0.0 111.045 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -78.29 82.95 4.56 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.463 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 25.3 t70 -91.85 169.63 10.53 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.587 1.555 . . . . 0.0 110.439 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.573 ' O ' HG22 ' A' ' 42' ' ' VAL . 45.9 t -44.25 -65.73 0.48 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 126.508 1.923 . . . . 0.0 112.637 170.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.4 mmm -68.03 -21.73 65.0 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.896 -0.503 . . . . 0.0 111.522 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.463 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -74.49 -23.87 58.93 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 118.273 -0.87 . . . . 0.0 112.053 174.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' SER . 2.9 m -67.96 -39.55 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 171.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 t -63.35 -44.46 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.162 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.06 -44.37 96.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.306 -1.316 . . . . 0.0 112.887 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -74.2 -30.37 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-O 119.318 -0.373 . . . . 0.0 111.595 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.519 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -61.56 -55.86 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.46 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.9 m -56.12 -39.83 72.82 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 124.629 1.206 . . . . 0.0 111.369 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.403 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -64.69 -46.01 84.19 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.767 0.827 . . . . 0.0 111.69 178.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.403 HD22 HG21 ' A' ' 10' ' ' ILE . 3.5 mm? -54.96 -44.8 74.7 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.328 0.651 . . . . 0.0 110.244 174.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 10.2 mm-40 -53.72 -50.02 66.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.524 1.129 . . . . 0.0 111.447 176.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.6 mm-40 -64.84 -55.8 17.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.542 0.737 . . . . 0.0 111.954 -174.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.403 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 56.5 m-85 -62.6 -56.02 21.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.365 0.666 . . . . 0.0 111.954 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.39 -9.74 59.66 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.2 t70 67.15 35.4 4.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 124.502 1.121 . . . . 0.0 111.106 169.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -173.6 3.44 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.262 0.625 . . . . 0.0 110.772 -171.053 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.4 m -128.9 113.43 15.22 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.382 0.673 . . . . 0.0 111.362 172.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.74 118.3 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 164.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.591 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 20.7 t70 -72.28 145.88 47.57 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.175 0.443 . . . . 0.0 109.98 -174.208 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.46 -25.98 67.75 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 121.706 -0.621 . . . . 0.0 112.468 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -76.44 -7.2 54.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.952 0.501 . . . . 0.0 112.071 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.9 pt-20 -111.29 -20.25 12.36 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.825 0.45 . . . . 0.0 110.575 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 58' ' ' ASP . 56.3 mt -77.69 114.58 18.38 Favored 'Isoleucine or valine' 0 C--N 1.357 0.928 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 175.381 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.6 p -131.75 177.22 7.69 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.676 1.191 . . . . 0.0 108.127 168.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.04 73.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.676 0.75 . . . . 0.0 109.756 171.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -69.79 -11.37 60.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.261 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -80.14 -40.46 27.34 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 122.797 0.439 . . . . 0.0 110.023 173.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.676 ' HA ' HD21 ' A' ' 73' ' ' LEU . 37.7 m-85 -99.31 14.03 31.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.548 0.339 . . . . 0.0 111.775 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 11.4 pt-20 -60.95 -40.39 93.11 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 123.786 0.679 . . . . 0.0 112.0 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.2 m -151.82 150.11 29.76 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.096 0.958 . . . . 0.0 109.796 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 tp -53.54 -42.75 67.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.125 0.97 . . . . 0.0 111.861 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.78 -38.23 91.7 Favored Glycine 0 C--N 1.341 0.822 0 O-C-N 124.534 1.146 . . . . 0.0 112.251 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m -58.79 -53.52 57.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.217 0.607 . . . . 0.0 110.268 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.676 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.26 -39.01 91.48 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.385 0.274 . . . . 0.0 110.816 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.611 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.8 -46.23 91.32 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 124.493 1.121 . . . . 0.0 110.334 -177.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -65.07 -44.39 89.11 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.885 0.741 . . . . 0.0 110.883 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.474 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 15.9 m-85 -56.61 -46.9 80.65 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.73 0.412 . . . . 0.0 111.06 179.071 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.8 m -75.3 -24.63 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 122.832 0.453 . . . . 0.0 111.596 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.5 mm-40 -57.53 -43.58 84.47 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 169.036 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -67.07 -55.88 12.41 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.211 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -63.82 -54.21 38.63 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.698 0.799 . . . . 0.0 112.235 -168.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.82 -17.63 63.4 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 N--CA 1.48 1.041 0 C-N-CA 122.655 0.382 . . . . 0.0 111.191 177.465 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.695 0.283 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -99.02 -50.98 3.99 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.58 0.752 . . . . 0.0 111.074 172.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -82.09 0.31 41.2 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.664 -171.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -55.38 -34.76 64.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 123.53 0.519 . . . . 0.0 111.771 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -68.52 -45.01 73.36 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.834 0.709 . . . . 0.0 110.593 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.79 -33.73 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.096 0.559 . . . . 0.0 111.03 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.5 t -66.84 -49.95 69.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 122.872 0.469 . . . . 0.0 109.772 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HG3' ' NZ ' ' A' ' 21' ' ' LYS . 36.3 ptt180 -70.8 -22.18 62.39 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.172 0.589 . . . . 0.0 110.877 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -65.05 -52.89 53.25 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.58 0.752 . . . . 0.0 109.57 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.64 -44.62 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.948 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 65.2 mt -63.38 -44.12 95.65 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.697 0.76 . . . . 0.0 110.277 175.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.557 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -66.72 -19.18 69.06 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 114.665 -1.152 . . . . 0.0 113.582 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -90.83 -52.73 4.72 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.243 0.617 . . . . 0.0 110.788 176.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 84.7 t -68.42 -47.24 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.981 0.912 . . . . 0.0 110.815 -173.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.654 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -83.75 -14.29 51.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.768 0.427 . . . . 0.0 110.791 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 63.26 62.72 0.96 Allowed 'General case' 0 C--N 1.355 0.825 0 C-N-CA 124.446 1.099 . . . . 0.0 110.286 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.557 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 10.0 mp -72.88 -34.34 66.64 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 114.915 -1.038 . . . . 0.0 109.2 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.35 -94.61 0.27 Allowed Glycine 0 C--N 1.353 1.492 0 O-C-N 123.908 0.755 . . . . 0.0 112.418 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -92.95 -18.49 22.67 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.521 0.728 . . . . 0.0 110.614 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.457 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.4 -31.43 72.53 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.731 0.412 . . . . 0.0 110.19 -178.381 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.403 ' NZ ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -70.0 -26.23 63.97 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.763 0.425 . . . . 0.0 111.823 174.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -70.58 -48.4 55.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 20' ' ' ARG . 8.2 t -77.42 -7.21 55.79 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.784 -167.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.644 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 3.9 pp -103.22 157.2 17.17 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.679 0.392 . . . . 0.0 111.179 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 76.2 p -114.57 -169.54 1.56 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.327 1.051 . . . . 0.0 109.472 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.0 69.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.146 0.578 . . . . 0.0 111.35 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -69.54 -12.74 61.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.843 0.857 . . . . 0.0 112.847 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.644 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 46.0 t -59.21 134.56 57.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.972 0.909 . . . . 0.0 111.856 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -83.71 146.15 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.512 ' HA ' HG12 ' A' ' 34' ' ' ILE . 66.7 mt -114.27 -72.65 0.69 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.908 0.483 . . . . 0.0 110.642 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.35 113.36 2.87 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.23 -31.42 8.72 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-N 115.753 -0.658 . . . . 0.0 113.053 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -87.81 -57.61 2.88 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.838 0.455 . . . . 0.0 110.583 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.512 HG12 ' HA ' ' A' ' 30' ' ' LEU . 17.6 mm -71.74 119.82 76.44 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.45 -16.86 30.75 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.279 1.986 . . . . 0.0 111.807 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.435 ' H ' HG22 ' A' ' 34' ' ' ILE . 33.4 mm-40 -86.88 -21.33 26.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.491 0.717 . . . . 0.0 110.902 -177.156 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -74.39 86.1 2.0 Allowed 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -98.8 173.73 6.73 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.282 1.433 . . . . 0.0 109.731 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.589 ' O ' HG22 ' A' ' 42' ' ' VAL . 1.4 m -46.13 -64.52 0.73 Allowed 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 125.154 1.382 . . . . 0.0 113.22 169.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.7 mmt -63.71 -27.48 69.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 121.189 0.519 . . . . 0.0 110.928 -176.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -64.95 -35.96 82.84 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.583 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 39' ' ' SER . 3.7 m -66.47 -36.04 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-N 118.469 0.577 . . . . 0.0 109.644 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.0 t -64.85 -47.37 88.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 CA-C-O 121.391 0.615 . . . . 0.0 109.9 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -58.72 -46.09 88.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.185 -1.371 . . . . 0.0 112.954 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.1 -33.45 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.977 -0.535 . . . . 0.0 111.722 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 78.8 mt -62.79 -51.55 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 67.6 m -52.25 -44.52 64.93 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.639 1.212 . . . . 0.0 110.95 177.473 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.67 -48.89 79.78 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.755 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.5 -46.05 66.48 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.684 0.794 . . . . 0.0 110.592 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 5.8 mm-40 -56.34 -47.86 77.92 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.462 1.105 . . . . 0.0 111.05 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 47' ' ' THR . 24.0 mm-40 -65.28 -52.24 55.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.662 0.785 . . . . 0.0 111.736 -176.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -71.2 -38.25 72.06 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.8 -171.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -94.02 -8.08 40.91 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.776 0.43 . . . . 0.0 111.893 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 67.36 28.23 7.91 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.594 1.158 . . . . 0.0 111.963 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -126.17 -177.67 4.04 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.219 0.608 . . . . 0.0 111.09 -171.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.5 m -127.14 121.1 30.45 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.81 0.844 . . . . 0.0 110.959 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.43 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 10.8 t -74.66 134.4 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.555 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.2 t70 -76.18 137.72 40.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.869 0.467 . . . . 0.0 109.911 -176.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.28 -39.05 81.71 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.345 0.658 . . . . 0.0 112.104 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.13 -4.51 41.96 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.542 0.737 . . . . 0.0 112.746 -172.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -100.97 -31.76 10.96 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 58' ' ' ASP . 35.4 mt -70.43 111.96 4.8 Favored 'Isoleucine or valine' 0 C--N 1.354 0.781 0 CA-C-O 121.261 0.553 . . . . 0.0 110.568 -176.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 42.2 t -112.27 171.96 7.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.65 1.18 . . . . 0.0 108.414 169.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.1 -30.05 68.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 167.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -71.98 -10.37 59.68 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.055 0.942 . . . . 0.0 111.542 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.429 HG22 HD13 ' A' ' 73' ' ' LEU . 96.3 m -69.25 -33.16 72.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.596 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.8 m-85 -89.36 11.49 18.96 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 69' ' ' THR . 9.8 pt-20 -58.76 -47.42 84.74 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 118.084 0.402 . . . . 0.0 110.792 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' GLU . 62.7 p -140.18 162.63 34.79 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.508 0.723 . . . . 0.0 111.125 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.71 -42.46 93.1 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 124.056 0.943 . . . . 0.0 110.924 176.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.99 -27.4 70.33 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 124.476 1.11 . . . . 0.0 112.616 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.7 m -67.67 -52.46 37.69 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 122.729 0.412 . . . . 0.0 110.754 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -60.81 -38.24 84.72 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 117.788 0.267 . . . . 0.0 110.769 176.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.01 63.11 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 124.344 1.027 . . . . 0.0 110.049 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.25 -44.91 92.36 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 123.967 0.792 . . . . 0.0 110.483 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.513 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 6.5 m-85 -58.62 -55.83 30.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.207 0.603 . . . . 0.0 111.512 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.8 m -66.67 -27.36 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.412 0.285 . . . . 0.0 111.39 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.57 -28.26 63.72 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.051 0.54 . . . . 0.0 111.036 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 63.2 m170 -73.45 -38.16 65.57 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.753 0.421 . . . . 0.0 110.169 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -69.54 -54.07 15.93 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.887 0.875 . . . . 0.0 112.238 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.68 -14.47 60.35 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.958 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 51.5 m . . . . . 0 N--CA 1.482 1.161 0 CA-C-N 118.078 0.399 . . . . 0.0 110.559 174.186 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -97.99 -36.91 9.98 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.356 0.662 . . . . 0.0 110.869 177.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -77.89 -14.2 59.63 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-O 118.541 -0.742 . . . . 0.0 112.948 -167.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -51.89 -34.0 39.32 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 123.439 0.695 . . . . 0.0 112.068 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.49 -49.83 69.83 Favored 'General case' 0 C--N 1.352 0.715 0 C-N-CA 124.196 0.998 . . . . 0.0 110.671 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.64 -25.2 60.17 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.501 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.3 t -69.15 -48.83 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.634 0.373 . . . . 0.0 110.051 176.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 38.9 ptt180 -69.82 -25.58 63.83 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.52 0.328 . . . . 0.0 110.305 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -65.19 -47.42 77.01 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 123.577 0.548 . . . . 0.0 109.625 173.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 49' ' ' LEU . 75.3 mt -61.22 -57.75 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.75 0.82 . . . . 0.0 111.428 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.546 HD22 HD13 ' A' ' 30' ' ' LEU . 9.9 mp -66.26 -29.61 69.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.626 0.37 . . . . 0.0 110.59 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.474 ' HA2' HD23 ' A' ' 17' ' ' LEU . . . -66.7 -29.07 74.15 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 119.912 -0.382 . . . . 0.0 113.003 172.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.18 -48.63 17.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.44 0.696 . . . . 0.0 110.557 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 10' ' ' ILE . 59.6 t -66.58 -56.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.526 0.731 . . . . 0.0 110.293 -174.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.546 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -84.54 -2.37 57.24 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.95 0.5 . . . . 0.0 110.982 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 58.0 t30 60.77 50.88 5.13 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.636 1.174 . . . . 0.0 111.533 170.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.496 HD11 HG23 ' A' ' 34' ' ' ILE . 2.7 mm? -72.69 -34.05 66.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.943 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.67 -90.7 0.25 Allowed Glycine 0 C--N 1.348 1.223 0 O-C-N 123.486 0.491 . . . . 0.0 112.772 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -94.01 -23.16 18.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.622 0.769 . . . . 0.0 111.012 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.0 OUTLIER -68.32 -29.13 67.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.916 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.458 ' O ' ' HD2' ' A' ' 8' ' ' ARG . 9.5 pttm -69.89 -29.89 67.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.453 0.301 . . . . 0.0 111.017 173.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -75.52 -35.49 60.73 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.181 0.592 . . . . 0.0 110.775 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.2 t -83.49 -22.33 32.55 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.938 0.495 . . . . 0.0 111.67 -174.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -82.45 143.77 30.92 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.4 p -118.98 -174.47 2.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.765 1.226 . . . . 0.0 110.225 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.41 88.8 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.292 0.567 . . . . 0.0 111.213 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 m -84.57 3.85 34.84 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.859 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.0 t -95.31 151.31 19.37 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.676 0.79 . . . . 0.0 110.16 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -87.14 148.79 4.38 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.162 1.385 . . . . 0.0 110.183 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.546 HD13 HD22 ' A' ' 11' ' ' LEU . 70.3 mt -114.72 -68.46 0.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.278 0.631 . . . . 0.0 109.737 175.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.66 112.54 2.29 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.518 0.727 . . . . 0.0 109.256 176.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.37 -40.38 2.5 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 123.615 0.572 . . . . 0.0 112.292 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -83.12 -34.64 26.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.382 0.673 . . . . 0.0 110.835 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.496 HG23 HD11 ' A' ' 17' ' ' LEU . 34.7 mm -87.97 117.16 68.13 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 173.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.27 0.27 10.16 Favored 'Trans proline' 0 C--N 1.369 1.623 0 C-N-CA 122.711 2.274 . . . . 0.0 112.562 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.47 ' H ' HG22 ' A' ' 34' ' ' ILE . 10.9 mm-40 -95.08 -18.03 21.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.909 0.884 . . . . 0.0 109.947 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -81.45 92.54 6.47 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -107.12 -164.75 1.01 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.192 0.997 . . . . 0.0 111.068 176.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.581 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.0 t -49.6 -69.3 0.12 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.294 1.838 . . . . 0.0 112.953 176.238 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.8 mmm -68.84 -19.06 64.25 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.895 -0.503 . . . . 0.0 111.233 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -65.82 -43.3 89.0 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-O 118.706 -0.664 . . . . 0.0 111.538 174.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 39' ' ' SER . 4.5 m -61.43 -38.22 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.38 -47.33 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.964 -176.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -61.51 -40.47 94.72 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.017 -1.447 . . . . 0.0 112.445 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.411 ' O ' HD23 ' A' ' 49' ' ' LEU . 31.0 m -77.38 -31.22 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.13 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.8 mt -61.76 -54.05 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 71.7 m -58.62 -39.5 80.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 124.807 1.317 . . . . 0.0 111.357 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -48.1 83.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.601 0.76 . . . . 0.0 111.195 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 10' ' ' ILE . 3.8 mm? -53.73 -46.32 70.81 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.432 0.693 . . . . 0.0 110.496 174.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.2 mm-40 -55.03 -46.82 75.31 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 124.172 0.92 . . . . 0.0 111.016 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' THR . 16.0 mm-40 -70.5 -52.16 23.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.109 -174.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -68.93 -35.03 76.33 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -97.48 -6.58 33.44 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 64.34 36.9 8.8 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.329 1.052 . . . . 0.0 112.076 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -132.83 -175.48 3.79 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.711 0.404 . . . . 0.0 110.642 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.76 127.64 33.2 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 122.626 0.37 . . . . 0.0 110.917 172.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.22 129.9 36.68 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.429 ' O ' HG13 ' A' ' 62' ' ' ILE . 21.5 t70 -77.16 148.52 35.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.101 0.56 . . . . 0.0 110.37 -175.044 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.48 -43.21 71.53 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.137 0.975 . . . . 0.0 112.288 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.87 -12.06 61.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.838 0.855 . . . . 0.0 113.015 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -107.47 -15.74 14.54 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 117.918 0.326 . . . . 0.0 110.909 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 58' ' ' ASP . 52.3 mt -74.98 106.53 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 173.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.8 t -126.48 171.28 11.18 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.634 1.173 . . . . 0.0 109.346 173.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.08 -26.7 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 121.137 0.494 . . . . 0.0 109.95 168.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -70.37 -10.7 59.77 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.053 0.941 . . . . 0.0 111.488 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.465 HG22 HD13 ' A' ' 73' ' ' LEU . 56.1 m -72.46 -38.1 68.33 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.907 0.483 . . . . 0.0 109.802 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.593 ' HA ' HD21 ' A' ' 73' ' ' LEU . 74.6 m-85 -99.11 9.24 43.88 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -175.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.18 -44.86 96.63 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.246 0.341 . . . . 0.0 110.921 -176.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 49.6 p -137.28 159.6 41.45 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.923 0.889 . . . . 0.0 110.225 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.96 -34.17 72.91 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 123.871 0.732 . . . . 0.0 111.127 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.27 -40.39 98.53 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 124.518 1.136 . . . . 0.0 112.194 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.414 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 38.9 m -60.84 -50.74 72.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.32 0.648 . . . . 0.0 110.845 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.593 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -58.0 -45.24 87.14 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 123.257 0.348 . . . . 0.0 110.492 176.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.608 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.49 -44.1 80.32 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 124.667 1.229 . . . . 0.0 110.392 -179.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.2 -52.0 64.74 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.422 1.076 . . . . 0.0 110.277 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 31.6 m-85 -54.91 -58.97 5.46 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.118 0.886 . . . . 0.0 110.966 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 73' ' ' LEU . 29.5 m -66.4 -24.08 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.416 0.686 . . . . 0.0 112.791 -176.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 63.3 mm-40 -59.97 -52.13 66.73 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 169.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -65.5 -41.61 93.03 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.012 -172.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.469 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 27.7 mmmt -73.63 -43.93 58.29 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 123.762 0.663 . . . . 0.0 111.741 -172.284 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.87 -17.01 56.31 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 122.673 0.389 . . . . 0.0 111.548 -177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.975 0.417 . . . . 0.0 111.285 174.747 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -98.53 -36.43 9.92 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.39 1.076 . . . . 0.0 110.739 176.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -75.74 -12.25 60.15 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.05 0.94 . . . . 0.0 112.941 -168.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -54.91 -30.93 59.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.844 0.715 . . . . 0.0 111.872 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.44 -44.76 70.63 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.885 0.874 . . . . 0.0 110.709 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.421 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.09 -32.06 69.94 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 177.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.69 -47.58 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 122.963 0.505 . . . . 0.0 109.93 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.541 ' HA ' HD12 ' A' ' 11' ' ' LEU . 31.4 ptt180 -68.08 -29.94 69.01 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.383 0.427 . . . . 0.0 109.999 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.569 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.4 t30 -60.89 -46.31 91.15 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.473 0.709 . . . . 0.0 110.025 174.146 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.475 HG21 HD22 ' A' ' 49' ' ' LEU . 86.1 mt -60.83 -44.8 98.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.418 176.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' A' ' 8' ' ' ARG . 39.9 mt -62.14 -38.17 87.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.061 0.544 . . . . 0.0 111.066 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.587 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -73.34 -25.91 71.68 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.145 -0.48 . . . . 0.0 113.481 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.35 -51.3 17.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.649 0.78 . . . . 0.0 110.554 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.7 t -77.18 -55.32 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.669 -173.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.483 HD11 HD13 ' A' ' 37' ' ' LEU . 33.7 mt -84.02 -4.12 58.51 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.966 -171.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 68.16 44.46 1.41 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 124.694 1.197 . . . . 0.0 111.474 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 9.9 mp -73.61 -36.31 65.47 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.298 174.098 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 65.6 -87.1 0.09 OUTLIER Glycine 0 C--N 1.354 1.549 0 O-C-N 123.829 0.706 . . . . 0.0 112.659 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.23 -28.14 19.05 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.52 0.728 . . . . 0.0 111.123 177.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.486 HH11 HD23 ' A' ' 24' ' ' LEU . 2.0 tmt_? -67.31 -22.92 65.61 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.937 0.895 . . . . 0.0 110.411 -173.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.3 pttt -67.25 -29.29 68.88 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.028 0.531 . . . . 0.0 111.139 176.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -95.09 -18.96 20.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.452 0.701 . . . . 0.0 110.658 -173.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.405 HG22 ' O ' ' A' ' 20' ' ' ARG . 5.9 t -81.43 -10.98 59.4 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.732 0.413 . . . . 0.0 111.121 176.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.486 HD23 HH11 ' A' ' 20' ' ' ARG . 4.1 pp -102.66 152.8 20.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.813 0.445 . . . . 0.0 110.571 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.7 p -122.97 -171.63 2.33 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.485 1.114 . . . . 0.0 110.095 -174.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.73 67.57 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.308 0.643 . . . . 0.0 112.357 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.1 m -74.86 -26.71 59.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.614 0.766 . . . . 0.0 112.171 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 86.5 p -63.28 131.48 48.49 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 122.938 0.495 . . . . 0.0 111.34 -172.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.03 149.17 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.508 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.2 mt -111.17 -67.9 0.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.6 mt -57.92 112.13 1.39 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.601 0.36 . . . . 0.0 110.328 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 99.1 -28.93 13.01 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 115.426 -0.806 . . . . 0.0 113.569 177.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -88.62 -47.48 8.25 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 117.254 0.527 . . . . 0.0 110.63 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 30' ' ' LEU . 27.9 mm -76.25 115.74 49.78 Favored Pre-proline 0 N--CA 1.472 0.64 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 177.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.91 -5.14 16.43 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 122.381 2.054 . . . . 0.0 112.856 -174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -107.13 -0.24 22.95 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.461 0.704 . . . . 0.0 110.911 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.483 HD13 HD11 ' A' ' 15' ' ' LEU . 39.1 tp -94.74 80.29 3.76 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.466 0.65 . . . . 0.0 109.529 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 42' ' ' VAL . 3.8 p30 -95.97 -165.88 1.35 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.273 1.029 . . . . 0.0 110.275 176.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.623 ' O ' HG22 ' A' ' 42' ' ' VAL . 35.5 t -52.98 -69.58 0.11 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 125.391 1.476 . . . . 0.0 113.05 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 15.5 mmt -66.0 -23.84 66.65 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.793 -0.567 . . . . 0.0 111.388 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.63 83.6 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 175.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 39' ' ' SER . 15.1 m -66.99 -35.75 75.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.549 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 t -65.0 -41.42 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 121.503 0.668 . . . . 0.0 110.701 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -61.93 -46.96 87.04 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 114.445 -1.252 . . . . 0.0 112.089 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.1 m -70.16 -28.99 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 CA-C-O 119.194 -0.431 . . . . 0.0 111.669 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.461 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 84.2 mt -59.0 -55.51 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.412 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 52.3 m -57.62 -42.46 83.34 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.918 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -38.77 90.89 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.941 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.475 HD22 HG21 ' A' ' 10' ' ' ILE . 2.4 mm? -56.98 -48.51 78.24 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.8 mm-40 -52.09 -50.91 60.69 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.491 1.119 . . . . 0.0 110.656 177.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 47' ' ' THR . 61.8 mm-40 -63.66 -58.12 7.91 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.642 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -69.47 -35.54 75.7 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -170.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -89.89 -13.6 36.02 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.13 49.18 2.74 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.088 0.955 . . . . 0.0 111.357 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -143.49 -169.48 3.07 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.087 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.0 t -138.01 131.26 30.45 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.959 0.503 . . . . 0.0 110.664 172.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.0 t -90.89 129.97 40.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 168.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.453 ' O ' HG13 ' A' ' 62' ' ' ILE . 36.2 t70 -74.79 148.39 40.39 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -65.84 -28.41 68.96 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.606 0.363 . . . . 0.0 111.789 -174.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.08 -29.25 66.2 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.71 0.804 . . . . 0.0 111.109 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -94.14 -13.48 26.69 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 122.623 0.369 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 58' ' ' ASP . 61.7 mt -75.7 107.82 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 172.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.5 t -115.7 167.31 11.03 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.933 0.893 . . . . 0.0 109.636 173.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.24 -31.83 73.18 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 165.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -71.26 -10.98 60.65 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.449 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.453 HG22 HD13 ' A' ' 73' ' ' LEU . 41.1 m -79.21 -41.38 28.44 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.069 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.585 ' HA ' HD21 ' A' ' 73' ' ' LEU . 43.2 m-85 -99.0 11.95 37.44 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.711 0.804 . . . . 0.0 113.048 -174.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.557 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.4 pt-20 -61.22 -44.62 96.98 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.294 0.638 . . . . 0.0 111.749 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.557 HG22 ' HG3' ' A' ' 68' ' ' GLU . 8.0 t -148.0 158.68 44.18 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 110.229 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.37 -35.89 70.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.572 0.749 . . . . 0.0 111.434 -178.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.87 -42.07 96.47 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.492 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -63.95 -47.31 80.96 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.295 0.638 . . . . 0.0 111.44 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.585 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -57.53 -45.03 85.5 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.49 -44.79 89.54 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.835 1.334 . . . . 0.0 110.899 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -58.73 -51.12 71.33 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 123.972 0.795 . . . . 0.0 110.645 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 22.7 m-85 -56.08 -55.34 34.17 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.74 -24.97 31.6 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 123.055 0.542 . . . . 0.0 111.774 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.3 mm-40 -56.49 -56.88 15.71 Favored 'General case' 0 C--N 1.365 1.248 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -59.85 -46.35 89.55 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.196 0.935 . . . . 0.0 111.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.7 mmmt -57.97 -55.81 30.1 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.365 1.066 . . . . 0.0 112.034 -176.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.29 -13.71 59.73 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.876 -175.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.482 1.137 0 CA-C-N 117.953 0.342 . . . . 0.0 111.445 173.304 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.457 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 1.9 tpt . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -54.99 -36.74 65.73 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -163.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' ' 7' ' ' VAL . 11.0 m-70 -73.5 -9.31 58.56 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.412 -173.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.7 -32.62 59.75 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.133 0.573 . . . . 0.0 110.166 173.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.56 -52.03 43.54 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.466 -176.443 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.32 -35.01 75.51 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.14 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 3' ' ' HIS . 97.5 t -66.18 -47.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 122.585 0.354 . . . . 0.0 110.361 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.479 ' HA ' HD12 ' A' ' 11' ' ' LEU . 36.2 ptt180 -69.88 -27.18 64.6 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.646 0.378 . . . . 0.0 110.431 -178.082 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -61.63 -45.66 93.12 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.222 173.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 6' ' ' ALA . 92.8 mt -64.09 -46.33 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.58 1.152 . . . . 0.0 111.508 177.133 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 8' ' ' ARG . 52.1 mt -61.58 -43.03 99.61 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.321 0.648 . . . . 0.0 110.966 -177.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.11 -19.14 77.66 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.056 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -75.09 -42.18 57.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 110.232 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 79.9 t -83.14 -46.23 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.26 -172.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -99.02 1.07 45.06 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.896 0.478 . . . . 0.0 111.991 -177.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.7 t30 60.05 63.19 1.48 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.86 1.264 . . . . 0.0 111.367 173.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.476 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 10.0 mp -81.49 -29.67 33.58 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.764 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 72.77 -105.94 1.85 Allowed Glycine 0 C--N 1.348 1.215 0 O-C-N 123.555 0.535 . . . . 0.0 112.35 176.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.6 -24.23 36.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.261 0.624 . . . . 0.0 110.443 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.567 HH11 HD23 ' A' ' 24' ' ' LEU . 2.3 tmt_? -64.78 -35.4 80.98 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.654 0.781 . . . . 0.0 109.66 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 52.6 pttt -67.08 -23.34 65.84 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.525 0.515 . . . . 0.0 111.549 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -94.59 -42.72 8.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 122.634 0.374 . . . . 0.0 110.724 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 20' ' ' ARG . 14.5 t -75.51 3.96 8.38 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.489 0.716 . . . . 0.0 112.43 -172.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.567 HD23 HH11 ' A' ' 20' ' ' ARG . 3.1 pp -95.97 -179.79 4.81 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.758 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 45.3 p -133.12 -171.94 2.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.564 1.146 . . . . 0.0 109.124 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.1 66.3 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.45 0.7 . . . . 0.0 111.728 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.5 m -75.61 -5.42 45.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.984 0.914 . . . . 0.0 111.997 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 29.2 t -71.0 130.47 41.66 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.928 0.491 . . . . 0.0 110.674 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.0 t -87.13 138.43 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.473 ' HA ' HG12 ' A' ' 34' ' ' ILE . 59.6 mt -105.62 -71.58 0.74 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.892 0.477 . . . . 0.0 111.304 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 71.1 mt -53.96 118.98 4.43 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 123.705 0.628 . . . . 0.0 111.02 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.43 -41.65 3.1 Favored Glycine 0 C--N 1.342 0.869 0 O-C-N 123.967 0.792 . . . . 0.0 113.401 177.132 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -72.14 -48.63 42.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.655 0.782 . . . . 0.0 111.19 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.473 HG12 ' HA ' ' A' ' 30' ' ' LEU . 35.3 mm -73.69 116.99 57.21 Favored Pre-proline 0 CA--C 1.545 0.758 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -74.15 -0.24 9.33 Favored 'Trans proline' 0 C--N 1.369 1.653 0 C-N-CA 122.8 2.333 . . . . 0.0 113.224 -175.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.417 ' H ' HG22 ' A' ' 34' ' ' ILE . 13.6 mm-40 -107.93 -2.4 19.81 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.915 0.886 . . . . 0.0 110.525 178.407 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 tt -106.19 102.59 11.99 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -175.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -112.48 -164.53 0.92 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.487 1.115 . . . . 0.0 110.583 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.545 ' O ' HG22 ' A' ' 42' ' ' VAL . 45.0 t -45.38 -67.67 0.26 Allowed 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 126.668 1.987 . . . . 0.0 113.231 171.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 22.3 mmt -62.48 -25.97 68.28 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.032 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 45' ' ' VAL . . . -64.99 -38.69 91.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 118.874 -0.584 . . . . 0.0 112.276 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.545 HG22 ' O ' ' A' ' 39' ' ' SER . 2.5 m -61.11 -38.45 79.66 Favored 'Isoleucine or valine' 0 C--N 1.368 1.406 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 176.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.6 t -69.58 -45.43 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.771 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -57.59 -42.72 83.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.124 -1.398 . . . . 0.0 112.077 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 41' ' ' ALA . 21.2 m -78.91 -28.03 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.492 -0.766 . . . . 0.0 112.175 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.6 mt -59.83 -55.59 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 171.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.426 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 30.1 m -54.52 -48.7 71.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.921 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.07 99.12 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.057 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -54.87 -51.66 65.25 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.283 0.633 . . . . 0.0 109.831 175.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.8 mm-40 -54.01 -44.2 70.7 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.471 1.108 . . . . 0.0 111.181 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 47' ' ' THR . 13.1 mm-40 -63.25 -64.15 0.99 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.71 -179.125 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -61.98 -41.43 98.01 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.703 0.801 . . . . 0.0 113.049 -170.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.419 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 65.2 m-85 -88.0 -21.32 24.89 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 118.962 -0.542 . . . . 0.0 112.016 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 63.88 58.95 1.17 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.18 0.992 . . . . 0.0 111.113 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -147.38 -177.19 5.56 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.003 -0.998 . . . . 0.0 109.749 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.2 t -131.1 117.9 19.77 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.531 0.333 . . . . 0.0 111.014 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.6 t -76.8 124.89 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 168.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 34.1 t70 -65.6 135.92 55.68 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.597 0.359 . . . . 0.0 110.315 -176.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -60.83 -27.58 68.18 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.243 0.617 . . . . 0.0 112.037 -173.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -82.07 -19.0 41.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.302 0.641 . . . . 0.0 112.272 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -92.29 -19.67 21.91 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 176.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 58' ' ' ASP . 57.7 mt -72.84 113.51 10.58 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.2 t -129.5 175.62 8.64 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 125.066 1.346 . . . . 0.0 108.389 175.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.45 -30.24 70.55 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 168.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -72.57 -13.6 61.43 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.603 0.761 . . . . 0.0 111.758 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 49.5 m -78.31 -32.42 49.27 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.054 0.542 . . . . 0.0 109.625 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.491 ' HA ' HD21 ' A' ' 73' ' ' LEU . 59.1 m-85 -108.94 7.16 25.83 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.633 0.773 . . . . 0.0 112.998 -177.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.96 -40.53 95.14 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 117.655 0.207 . . . . 0.0 111.043 -176.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.7 p -135.65 163.86 29.18 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.727 0.811 . . . . 0.0 110.241 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.48 -35.83 78.76 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.582 173.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.42 -30.99 75.79 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.026 0.829 . . . . 0.0 112.68 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.4 m -67.92 -51.73 44.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.353 0.661 . . . . 0.0 110.458 176.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.92 -46.99 86.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 122.915 0.134 . . . . 0.0 110.864 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -52.74 -50.39 63.55 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.596 1.185 . . . . 0.0 109.742 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.32 -56.48 18.09 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.582 1.153 . . . . 0.0 110.426 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.461 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.4 m-85 -57.21 -54.76 43.08 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.95 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 17.2 m -67.79 -25.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.048 0.539 . . . . 0.0 111.616 -176.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 69.1 mm-40 -60.56 -46.65 89.42 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 171.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -59.03 -50.74 72.94 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 123.518 0.511 . . . . 0.0 110.665 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -63.48 -50.99 67.5 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.715 -170.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.12 -13.93 60.9 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.155 0.582 . . . . 0.0 112.157 -177.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.48 1.032 0 C-N-CA 122.69 0.396 . . . . 0.0 111.553 172.543 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.22 0.533 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.24 -34.48 10.32 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.096 0.959 . . . . 0.0 110.394 170.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.406 ' O ' HG23 ' A' ' 7' ' ' VAL . 32.2 m170 -75.06 -20.05 59.72 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -53.71 -28.95 36.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 123.57 0.543 . . . . 0.0 111.898 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -65.26 -48.38 73.41 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 123.514 0.726 . . . . 0.0 111.083 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.13 -30.81 62.48 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.169 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 3' ' ' HIS . 91.7 t -65.08 -46.6 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 39.6 ptt180 -74.56 -24.89 59.0 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.988 0.515 . . . . 0.0 110.641 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.431 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 48.7 t30 -61.45 -47.04 87.55 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 172.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.403 HG21 HD22 ' A' ' 49' ' ' LEU . 93.6 mt -62.35 -45.66 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.955 176.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.41 -42.9 98.76 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.797 0.439 . . . . 0.0 110.961 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.518 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -70.58 -18.93 76.01 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.206 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -81.85 -52.49 7.05 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.053 0.541 . . . . 0.0 111.161 174.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.9 t -68.05 -57.99 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.321 0.648 . . . . 0.0 109.84 -175.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.471 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.0 mm? -81.21 -10.93 59.53 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 123.649 0.593 . . . . 0.0 111.272 -176.021 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 66.65 47.94 1.51 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.454 1.102 . . . . 0.0 110.868 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 3.5 mm? -66.53 -34.38 77.79 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 171.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.95 -93.27 0.15 Allowed Glycine 0 C--N 1.355 1.588 0 O-C-N 123.938 0.774 . . . . 0.0 112.988 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -79.19 -34.52 42.95 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.353 1.061 . . . . 0.0 110.413 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HA ' HG22 ' A' ' 23' ' ' THR . 1.7 tmt_? -68.58 -25.34 64.84 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.577 -171.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 56.1 pttt -64.98 -29.06 69.96 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.476 0.179 . . . . 0.0 111.33 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -85.53 -29.9 23.84 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 122.864 0.465 . . . . 0.0 110.982 -175.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 20' ' ' ARG . 12.1 t -84.37 -9.86 58.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.045 0.538 . . . . 0.0 111.819 -176.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 pp -94.22 151.79 19.19 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 177.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.0 p -112.67 -173.54 2.27 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.809 0.844 . . . . 0.0 109.938 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 -23.62 66.11 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.042 0.537 . . . . 0.0 111.332 172.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.3 m -81.16 0.98 33.93 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.26 1.024 . . . . 0.0 112.734 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.7 t -81.94 137.7 35.12 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.653 0.381 . . . . 0.0 110.651 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -86.91 145.76 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 124.331 1.052 . . . . 0.0 109.188 175.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.4 mt -108.18 -70.68 0.79 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.233 0.613 . . . . 0.0 110.676 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.483 HD23 HD12 ' A' ' 37' ' ' LEU . 21.4 mt -51.3 113.99 1.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.243 1.017 . . . . 0.0 112.269 178.072 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.49 -27.93 4.03 Favored Glycine 0 C--N 1.348 1.202 0 O-C-N 123.942 0.777 . . . . 0.0 114.059 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -76.7 -59.74 2.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.319 0.648 . . . . 0.0 109.915 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.439 HG22 ' H ' ' A' ' 36' ' ' GLU . 43.9 mm -70.84 121.98 85.49 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 173.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -69.37 -9.22 25.67 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 122.653 2.235 . . . . 0.0 112.452 -175.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 16.6 mm-40 -94.48 -21.87 18.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.831 0.853 . . . . 0.0 110.528 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.483 HD12 HD23 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -82.45 80.77 8.52 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -174.191 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 11.3 t70 -112.55 -168.45 1.32 Allowed 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 125.204 1.402 . . . . 0.0 109.516 -177.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.2 t -51.06 -70.42 0.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 125.751 1.621 . . . . 0.0 114.486 -173.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.8 mmm -65.0 -22.06 66.94 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.632 -0.667 . . . . 0.0 111.251 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.471 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -67.07 -35.96 80.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.481 0.713 . . . . 0.0 111.932 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -64.54 -37.9 81.24 Favored 'Isoleucine or valine' 0 C--N 1.372 1.545 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.1 t -67.66 -44.33 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.684 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -61.7 -38.85 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.132 -1.394 . . . . 0.0 112.532 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.416 ' O ' HD23 ' A' ' 49' ' ' LEU . 30.1 m -80.1 -29.15 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.097 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.559 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -59.8 -57.06 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 171.412 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.9 m -55.72 -44.39 77.43 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.624 1.202 . . . . 0.0 111.37 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.49 -47.79 84.13 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.003 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -52.17 -49.75 63.18 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.424 0.69 . . . . 0.0 110.174 174.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.9 mm-40 -57.47 -43.25 83.89 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.994 0.918 . . . . 0.0 111.368 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -67.08 -52.45 41.93 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.785 0.834 . . . . 0.0 112.59 -176.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -69.57 -39.35 77.42 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.404 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 72.7 m-85 -91.03 -16.8 27.32 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 57.97 64.27 1.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 124.611 1.164 . . . . 0.0 111.11 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.404 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -149.24 -176.36 5.34 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.679 0.792 . . . . 0.0 109.622 178.156 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -134.89 116.73 15.08 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 122.357 0.263 . . . . 0.0 111.421 171.072 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.556 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.8 t -69.34 127.85 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 168.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.466 ' O ' HG13 ' A' ' 62' ' ' ILE . 32.0 t70 -72.41 142.86 48.68 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 118.142 0.428 . . . . 0.0 110.767 -173.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -50.3 -44.65 54.1 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.521 1.128 . . . . 0.0 112.592 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.7 -21.76 64.39 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.107 -174.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -97.98 -20.97 17.09 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.157 0.183 . . . . 0.0 110.909 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 58' ' ' ASP . 60.9 mt -75.47 117.48 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 0.0 110.264 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 t -144.37 179.59 7.15 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 124.117 0.967 . . . . 0.0 109.491 174.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.7 74.02 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.71 0.804 . . . . 0.0 110.151 167.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -67.84 -17.15 64.41 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -81.11 -37.82 28.27 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.453 0.701 . . . . 0.0 110.024 174.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.504 ' HA ' HD21 ' A' ' 73' ' ' LEU . 39.2 m-85 -104.85 14.7 29.11 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.28 0.632 . . . . 0.0 112.402 -176.148 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.54 -46.14 89.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.65 0.38 . . . . 0.0 110.605 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.3 p -137.28 158.41 44.49 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.638 0.775 . . . . 0.0 110.43 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.3 tp -55.41 -39.72 70.56 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.504 0.722 . . . . 0.0 110.71 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.46 95.76 Favored Glycine 0 C--N 1.347 1.176 0 O-C-N 124.452 1.095 . . . . 0.0 112.474 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -60.09 -45.31 93.38 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 122.787 0.435 . . . . 0.0 110.978 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.86 -42.18 99.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 122.999 0.187 . . . . 0.0 110.759 175.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.564 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.16 -49.03 79.42 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 124.153 0.908 . . . . 0.0 111.03 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.84 -43.74 92.07 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.634 0.774 . . . . 0.0 110.696 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.517 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 7.1 m-85 -58.08 -52.0 67.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 119.235 -0.412 . . . . 0.0 110.587 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.3 m -70.88 -24.73 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.003 0.521 . . . . 0.0 111.975 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 78.6 mm-40 -56.71 -44.85 81.99 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 168.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -73.19 -39.42 65.6 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.307 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.556 ' HE2' ' HA ' ' A' ' 57' ' ' VAL . 32.5 mmmt -64.91 -53.0 53.39 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.481 0.712 . . . . 0.0 111.912 -173.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.07 -13.1 60.45 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.436 -177.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 123.78 0.832 . . . . 0.0 111.845 172.472 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.618 0.247 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -98.02 -37.82 9.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.009 0.923 . . . . 0.0 110.323 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.4 m80 -75.14 -12.98 60.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.992 0.917 . . . . 0.0 113.102 -169.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -57.67 -22.13 44.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 123.541 0.526 . . . . 0.0 111.689 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.3 -58.98 6.18 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.265 1.026 . . . . 0.0 110.926 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.66 58.82 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.783 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 87.4 t -63.53 -54.84 27.41 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -69.28 -28.04 65.95 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.289 0.236 . . . . 0.0 110.516 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -60.1 -52.57 64.77 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.319 0.647 . . . . 0.0 109.906 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.434 HG21 HD22 ' A' ' 49' ' ' LEU . 92.6 mt -64.05 -51.9 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.997 -178.578 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.413 HD13 HD13 ' A' ' 30' ' ' LEU . 76.7 mt -61.05 -39.63 90.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.074 0.55 . . . . 0.0 111.59 -175.036 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.571 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.1 -23.94 70.24 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 121.329 -0.462 . . . . 0.0 113.366 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.34 -27.01 38.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.033 0.533 . . . . 0.0 110.915 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.2 t -86.28 -59.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.336 0.655 . . . . 0.0 109.644 177.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.462 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -77.38 3.77 12.42 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -174.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 71.5 38.01 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.293 1.037 . . . . 0.0 111.192 167.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.412 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.6 mp -75.78 -32.08 59.77 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.165 172.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.5 -95.9 0.27 Allowed Glycine 0 C--N 1.353 1.51 0 O-C-N 123.556 0.535 . . . . 0.0 113.224 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -90.11 -25.29 20.8 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.025 0.93 . . . . 0.0 110.897 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.11 -26.82 69.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.574 0.749 . . . . 0.0 111.348 -175.523 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.8 pttt -66.26 -30.32 70.73 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.041 0.537 . . . . 0.0 111.731 178.295 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -81.91 -22.3 36.87 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.513 0.725 . . . . 0.0 111.081 -175.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 t -93.49 2.62 56.38 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.836 0.454 . . . . 0.0 112.054 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.439 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -108.06 159.06 16.87 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.951 -0.468 . . . . 0.0 110.743 176.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -116.26 -174.92 2.64 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.663 0.785 . . . . 0.0 110.915 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -67.3 -17.69 64.88 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.28 0.632 . . . . 0.0 111.933 175.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -74.23 -24.03 59.25 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.34 0.656 . . . . 0.0 111.46 173.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.1 t -63.54 125.43 24.22 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.712 0.805 . . . . 0.0 111.455 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.8 t -79.23 147.14 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.413 HD13 HD13 ' A' ' 11' ' ' LEU . 67.5 mt -116.43 -68.14 0.94 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.241 0.616 . . . . 0.0 110.07 -177.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 tt -61.86 111.23 1.8 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.54 -26.95 22.67 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.461 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -88.92 -49.89 6.52 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 117.321 0.56 . . . . 0.0 110.671 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.4 mm -81.35 118.48 72.46 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.93 -6.68 18.4 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.686 2.257 . . . . 0.0 112.848 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -94.24 -18.14 21.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.88 0.872 . . . . 0.0 111.06 -175.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.5 tp -86.66 88.52 7.68 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 122.917 0.487 . . . . 0.0 109.719 -174.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.518 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 13.0 t70 -120.76 -170.68 2.04 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.045 0.938 . . . . 0.0 109.66 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.6 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.1 t -40.27 -69.4 0.13 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 127.615 2.366 . . . . 0.0 114.883 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -66.89 -29.76 69.74 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.211 -0.931 . . . . 0.0 111.761 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.518 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -66.79 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 39' ' ' SER . 28.6 m -70.42 -33.32 53.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.2 -46.79 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.509 0.671 . . . . 0.0 110.033 175.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -56.68 -48.71 77.04 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.27 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.409 HG22 ' HA ' ' A' ' 42' ' ' VAL . 27.6 m -72.45 -32.9 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.915 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.536 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -60.01 -52.26 63.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.3 m -55.06 -44.61 74.93 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 124.579 1.175 . . . . 0.0 111.177 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -42.35 99.66 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.763 0.825 . . . . 0.0 111.883 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.434 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -57.82 -46.29 84.92 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.071 0.548 . . . . 0.0 110.232 173.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.8 mm-40 -54.46 -44.18 72.33 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.232 1.013 . . . . 0.0 110.827 178.213 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' THR . 43.4 mm-40 -63.01 -57.18 11.56 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.724 -176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -66.35 -44.91 81.93 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.604 0.565 . . . . 0.0 112.258 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -88.56 -9.46 52.21 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 118.941 -0.552 . . . . 0.0 112.359 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 59.47 45.28 13.78 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.271 1.028 . . . . 0.0 111.656 175.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -139.02 -177.02 4.7 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.425 -174.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.7 t -134.49 113.66 12.05 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.2 t -69.06 131.91 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 16.9 t70 -67.37 134.04 50.73 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.46 0.704 . . . . 0.0 110.158 -176.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -57.98 -38.42 76.05 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.886 0.875 . . . . 0.0 112.949 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -72.35 -20.18 61.51 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.938 0.495 . . . . 0.0 111.995 -176.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 18.3 pt-20 -98.71 -8.92 25.34 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.382 0.273 . . . . 0.0 110.641 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 51.5 mt -87.09 117.81 31.94 Favored 'Isoleucine or valine' 0 C--N 1.359 0.979 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.8 t -155.91 -172.3 4.07 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.308 1.043 . . . . 0.0 108.459 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.85 77.75 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.719 0.408 . . . . 0.0 110.655 176.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.1 mm-40 -68.55 -12.26 61.04 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.149 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.48 HG22 HD13 ' A' ' 73' ' ' LEU . 23.2 m -81.29 -45.14 16.66 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.215 0.606 . . . . 0.0 109.606 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.542 ' HA ' HD21 ' A' ' 73' ' ' LEU . 70.0 m-85 -97.75 6.25 48.14 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -174.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.497 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -57.03 -45.13 83.33 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.724 0.64 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.497 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -146.63 160.21 42.46 Favored 'General case' 0 C--O 1.249 1.058 0 C-N-CA 123.466 0.707 . . . . 0.0 110.036 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 17.3 tp -58.84 -35.66 73.27 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.774 0.83 . . . . 0.0 110.852 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.82 -42.14 96.4 Favored Glycine 0 C--N 1.349 1.276 0 O-C-N 124.635 1.209 . . . . 0.0 112.107 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.5 m -62.58 -49.45 75.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.974 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -57.69 -46.22 84.61 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.137 0.426 . . . . 0.0 110.196 178.003 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.561 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.46 -39.37 90.65 Favored 'General case' 0 C--O 1.217 -0.65 0 O-C-N 124.529 1.143 . . . . 0.0 111.305 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.78 -49.68 67.47 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.733 0.813 . . . . 0.0 110.621 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 42.4 m-85 -55.72 -49.67 72.42 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.55 0.531 . . . . 0.0 110.32 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.2 m -70.73 -25.66 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -55.69 -48.81 74.48 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -66.9 -41.27 87.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.146 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -63.2 -54.1 42.84 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.65 0.78 . . . . 0.0 112.238 -173.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.44 -13.5 61.08 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.328 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 123.422 0.689 . . . . 0.0 111.45 174.092 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.613 ' SD ' ' HG3' ' A' ' 78' ' ' GLU . 7.1 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 9.9 pm0 -98.23 -39.32 8.91 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 0.0 111.724 -175.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' HG23 ' A' ' 7' ' ' VAL . 28.6 m170 -76.8 -10.97 59.75 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.24 -170.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -55.35 -31.88 62.08 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 118.664 0.666 . . . . 0.0 111.799 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.72 -41.54 59.98 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.447 0.699 . . . . 0.0 111.435 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.438 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.27 -37.22 83.09 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.959 176.181 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -67.1 -47.3 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.052 178.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.41 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 28.7 ptt180 -68.65 -25.93 65.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.563 0.345 . . . . 0.0 110.476 -179.313 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 23.8 t30 -61.86 -50.49 72.02 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.67 0.788 . . . . 0.0 109.531 173.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.558 HG21 HD22 ' A' ' 49' ' ' LEU . 91.5 mt -59.83 -42.72 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.651 1.18 . . . . 0.0 111.281 178.143 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 46.0 mt -68.96 -41.75 77.54 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.136 0.574 . . . . 0.0 111.056 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.461 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -71.91 -18.27 77.51 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 116.147 -0.478 . . . . 0.0 113.148 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -79.95 -53.75 6.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.848 0.859 . . . . 0.0 110.006 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.495 HG13 ' ND2' ' A' ' 44' ' ' ASN . 79.5 t -73.32 -49.54 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.09 0.956 . . . . 0.0 111.387 -173.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.413 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 0.9 OUTLIER -83.93 -3.09 57.69 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.269 0.228 . . . . 0.0 110.84 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 61.64 53.45 3.26 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 124.962 1.305 . . . . 0.0 111.214 172.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.446 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.8 mp -75.81 -28.16 58.22 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.8 171.434 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.46 -89.03 0.08 OUTLIER Glycine 0 C--N 1.353 1.491 0 O-C-N 124.211 0.944 . . . . 0.0 112.408 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -93.24 -29.34 15.74 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.827 0.851 . . . . 0.0 111.448 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.68 -26.35 66.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.99 0.516 . . . . 0.0 111.355 -170.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 58.1 pttt -58.57 -28.11 65.23 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.701 0.4 . . . . 0.0 111.569 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -79.08 -25.73 43.06 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.81 0.844 . . . . 0.0 110.957 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.1 t -93.81 1.46 56.44 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.614 0.366 . . . . 0.0 111.926 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -109.72 151.46 26.89 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.895 -0.503 . . . . 0.0 110.038 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.8 p -123.51 -171.73 2.37 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.688 0.795 . . . . 0.0 109.996 -175.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.7 -20.3 65.94 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.442 0.697 . . . . 0.0 112.478 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 m -75.89 -21.74 56.83 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.193 0.597 . . . . 0.0 111.859 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -71.55 137.62 48.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.669 0.787 . . . . 0.0 111.422 -175.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.88 160.72 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 C-N-CA 124.573 1.149 . . . . 0.0 109.224 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.6 mt -117.1 -68.51 0.91 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.03 109.31 1.24 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.805 174.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.25 -34.27 5.81 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.273 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -77.27 -57.65 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.425 HG22 ' H ' ' A' ' 36' ' ' GLU . 12.9 mm -81.73 116.46 63.3 Favored Pre-proline 0 CA--C 1.543 0.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -175.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -77.18 -8.08 17.4 Favored 'Trans proline' 0 C--N 1.369 1.633 0 C-N-CA 122.459 2.106 . . . . 0.0 112.02 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.425 ' H ' HG22 ' A' ' 34' ' ' ILE . 6.0 mm-40 -96.48 -6.82 36.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.983 0.913 . . . . 0.0 110.659 -178.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.1 tp -81.72 80.76 7.97 Favored 'General case' 0 C--N 1.349 0.584 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.431 ' N ' ' HB3' ' A' ' 41' ' ' ALA . 22.3 t70 -82.01 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.476 1.511 . . . . 0.0 110.607 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' VAL . 48.1 t -43.95 -66.73 0.35 Allowed 'General case' 0 CA--C 1.566 1.577 0 C-N-CA 126.163 1.785 . . . . 0.0 112.469 170.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 95.0 mmm -70.56 -15.26 62.75 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.652 -0.655 . . . . 0.0 111.748 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.431 ' HB3' ' N ' ' A' ' 38' ' ' ASP . . . -77.22 -25.34 51.56 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.319 174.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' SER . 4.7 m -69.61 -37.99 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.12 -42.33 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.648 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.495 ' ND2' HG13 ' A' ' 14' ' ' VAL . 59.6 t30 -68.26 -37.75 81.07 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.553 -176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.2 m -72.53 -35.71 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.69 177.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.503 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 93.1 mt -59.97 -48.51 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 33.0 m -56.86 -45.06 82.72 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 124.373 1.046 . . . . 0.0 110.732 177.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.26 -41.65 98.63 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.689 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.558 HD22 HG21 ' A' ' 10' ' ' ILE . 3.4 mm? -56.58 -46.68 80.67 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.197 0.599 . . . . 0.0 109.9 176.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.2 mm-40 -51.66 -50.52 60.2 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.266 1.026 . . . . 0.0 110.386 176.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.2 mm-40 -59.81 -63.96 1.11 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.76 -176.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -65.05 -46.02 82.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.651 -169.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -87.67 -7.66 57.13 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.1 t70 65.19 36.41 7.17 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.93 0.892 . . . . 0.0 111.042 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.19 -175.53 3.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.413 0.685 . . . . 0.0 110.118 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -123.14 135.64 54.44 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 37.2 t -84.75 125.19 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 170.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' HG13 ' A' ' 62' ' ' ILE . 30.2 t70 -75.13 151.33 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.148 0.579 . . . . 0.0 111.083 -174.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -53.45 -41.76 66.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.406 1.082 . . . . 0.0 113.137 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -67.58 -17.96 64.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.836 0.854 . . . . 0.0 111.962 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -115.44 8.01 15.16 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.524 0.729 . . . . 0.0 111.436 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 58' ' ' ASP . 28.9 mt -98.41 105.44 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 77.5 p -146.27 173.23 12.43 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.645 0.778 . . . . 0.0 109.532 171.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.76 71.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 169.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.33 -21.1 66.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.147 0.579 . . . . 0.0 111.469 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.2 m -72.52 -40.31 66.89 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.259 0.624 . . . . 0.0 110.071 175.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.717 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.3 m-85 -97.43 18.32 15.55 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.634 0.774 . . . . 0.0 113.037 -174.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.533 ' HG3' HG22 ' A' ' 69' ' ' THR . 9.5 pt-20 -63.58 -46.34 86.29 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.681 0.392 . . . . 0.0 111.629 178.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.533 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -145.51 155.05 42.85 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 123.354 0.662 . . . . 0.0 110.531 -177.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.56 -32.73 67.41 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.724 0.81 . . . . 0.0 111.296 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.15 -41.68 98.25 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.953 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.2 m -60.4 -52.92 63.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.915 0.486 . . . . 0.0 110.33 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.717 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -61.34 -39.73 91.64 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 123.568 0.542 . . . . 0.0 110.938 -178.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.567 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.08 -49.68 75.1 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.424 1.077 . . . . 0.0 109.988 178.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.14 -39.46 89.86 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.708 0.63 . . . . 0.0 111.702 -177.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.508 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 34.9 m-85 -59.79 -54.75 42.64 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.7 m -67.1 -26.16 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 122.829 0.451 . . . . 0.0 111.787 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.613 ' HG3' ' SD ' ' A' ' 1' ' ' MET . 76.4 mm-40 -57.23 -51.9 67.49 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 170.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 47.9 m170 -63.01 -49.38 74.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.134 -175.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.1 mmmt -60.54 -55.15 36.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.784 0.834 . . . . 0.0 112.04 -172.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.59 -14.32 61.59 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.871 -176.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 122.963 0.505 . . . . 0.0 111.442 173.997 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.581 ' HG2' ' HB1' ' A' ' 74' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -96.88 -44.28 7.11 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 118.446 0.566 . . . . 0.0 112.067 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.423 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 82.6 m-70 -75.11 -12.86 60.4 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.939 -169.579 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.29 -31.2 63.43 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 118.216 0.462 . . . . 0.0 111.4 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -66.53 -52.88 41.0 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 125.006 1.322 . . . . 0.0 110.628 -178.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.1 -32.25 71.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.506 -178.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 3' ' ' HIS . 86.5 t -68.43 -48.67 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.742 0.417 . . . . 0.0 110.354 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 40.7 ptt180 -67.55 -30.11 69.67 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.449 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 37.4 t30 -62.24 -46.64 87.92 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.531 0.733 . . . . 0.0 109.914 176.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 6' ' ' ALA . 69.8 mt -61.71 -56.38 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 O-C-N 124.366 1.041 . . . . 0.0 111.672 179.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.547 HD22 HD13 ' A' ' 30' ' ' LEU . 9.7 mp -64.83 -34.03 77.4 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.922 0.139 . . . . 0.0 111.351 -176.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.54 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.79 -18.22 79.1 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 119.813 -0.437 . . . . 0.0 113.309 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.28 -53.04 7.34 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.742 0.417 . . . . 0.0 110.289 174.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.73 -58.57 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.325 1.05 . . . . 0.0 109.829 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 37' ' ' LEU . 64.0 mt -77.15 -8.21 57.14 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.135 -175.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.57 62.94 1.05 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.475 1.11 . . . . 0.0 110.717 172.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 4.1 mm? -85.27 -27.96 25.64 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.587 170.349 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 69.1 -107.5 2.12 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.873 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.33 -26.22 51.88 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.632 0.773 . . . . 0.0 111.147 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.574 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.68 -32.93 74.09 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.879 0.872 . . . . 0.0 110.068 -172.172 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.54 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.5 pttt -64.37 -34.83 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.95 -177.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -89.49 -21.19 23.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.218 0.207 . . . . 0.0 110.499 -173.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.437 HG22 ' HA ' ' A' ' 20' ' ' ARG . 6.8 t -91.96 7.14 43.51 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.027 0.531 . . . . 0.0 110.94 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -109.0 156.15 20.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.893 0.477 . . . . 0.0 109.77 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 p -111.88 -178.26 3.39 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.248 1.019 . . . . 0.0 110.709 -175.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.504 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -66.53 -27.66 67.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.363 0.665 . . . . 0.0 111.315 177.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.4 p -78.32 -4.04 46.06 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.65 0.78 . . . . 0.0 112.419 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.9 t -80.6 141.01 35.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.137 0.575 . . . . 0.0 110.198 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.3 t -80.65 151.63 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.437 1.095 . . . . 0.0 109.026 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 11' ' ' LEU . 82.5 mt -118.58 -69.74 0.83 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.131 0.572 . . . . 0.0 109.929 177.478 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.8 122.46 18.17 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 175.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.48 -34.78 5.04 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.006 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -86.32 -67.49 0.81 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.195 0.598 . . . . 0.0 111.014 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.453 HG22 ' H ' ' A' ' 36' ' ' GLU . 37.2 mm -64.47 119.66 58.69 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 123.278 0.631 . . . . 0.0 109.981 -172.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -72.9 -6.38 18.91 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.719 2.279 . . . . 0.0 112.699 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.453 ' H ' HG22 ' A' ' 34' ' ' ILE . 22.4 mm-40 -96.48 -14.6 22.24 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.756 0.822 . . . . 0.0 110.872 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.524 HD23 HD11 ' A' ' 15' ' ' LEU . 3.1 tm? -84.93 85.29 7.49 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -178.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.493 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 8.3 t70 -108.79 -173.19 2.21 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.377 1.071 . . . . 0.0 108.846 177.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -49.37 -70.93 0.07 Allowed 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 125.711 1.604 . . . . 0.0 114.5 -173.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -62.75 -25.58 68.27 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 121.708 -0.62 . . . . 0.0 111.358 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.493 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -69.43 -29.53 67.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.312 0.645 . . . . 0.0 112.355 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -65.98 -40.5 87.53 Favored 'Isoleucine or valine' 0 C--N 1.37 1.478 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 172.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.9 t -67.15 -40.43 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.463 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -65.12 -43.12 92.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.272 . . . . 0.0 112.037 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.0 m -72.52 -33.13 44.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.089 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -60.92 -48.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 173.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.463 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 68.1 m -55.77 -44.04 77.29 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 124.301 1.001 . . . . 0.0 110.528 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.57 86.54 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.212 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.442 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -54.21 -50.63 66.66 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 172.267 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -54.89 -46.04 74.76 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.17 177.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 47' ' ' THR . 30.0 mm-40 -61.66 -60.58 3.46 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.061 0.944 . . . . 0.0 112.093 -177.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -66.91 -46.29 75.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -172.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.502 ' HB3' HD11 ' A' ' 81' ' ' LEU . 93.4 m-85 -84.1 -19.64 33.92 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-O 119.082 -0.485 . . . . 0.0 112.078 -177.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.56 47.74 1.59 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.248 1.019 . . . . 0.0 111.633 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.456 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.5 OUTLIER -137.6 -174.27 3.72 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.906 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.8 t -134.84 117.08 15.52 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 122.767 0.427 . . . . 0.0 110.962 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.424 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 11.7 t -68.96 132.79 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.048 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 33.5 t70 -76.26 147.08 38.53 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.592 0.357 . . . . 0.0 110.392 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -57.39 -42.34 81.98 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.199 0.599 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.08 -14.96 62.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.209 0.604 . . . . 0.0 112.289 -174.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.8 pt-20 -103.31 -11.34 17.99 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.864 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 54.5 mt -85.92 116.17 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.234 0.614 . . . . 0.0 110.392 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -145.85 -178.96 6.38 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.879 1.272 . . . . 0.0 108.849 171.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 -34.37 78.22 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 171.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -71.94 -11.17 60.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.671 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.6 m -76.29 -36.67 58.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.226 0.61 . . . . 0.0 110.058 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.596 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.9 m-85 -99.79 14.76 29.18 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.948 0.499 . . . . 0.0 112.082 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -60.89 -45.62 93.86 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.432 0.293 . . . . 0.0 110.659 -178.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.0 p -138.04 163.59 31.22 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.784 0.833 . . . . 0.0 110.168 176.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.504 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 55.0 tp -59.29 -37.18 77.06 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.029 176.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.1 -34.3 89.57 Favored Glycine 0 C--N 1.34 0.753 0 CA-C-N 114.684 -1.144 . . . . 0.0 112.346 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -60.31 -54.89 40.24 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 122.859 0.464 . . . . 0.0 109.885 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.96 -44.3 91.46 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 124.025 0.828 . . . . 0.0 110.313 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -54.5 -46.87 73.55 Favored 'General case' 0 C--O 1.217 -0.636 0 O-C-N 124.64 1.212 . . . . 0.0 110.969 -178.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.48 HD22 ' SD ' ' A' ' 1' ' ' MET . 3.6 mm? -65.87 -47.64 74.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.813 0.845 . . . . 0.0 111.346 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 52.6 m-85 -56.39 -53.03 62.14 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.549 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.7 m -70.68 -23.81 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.653 0.781 . . . . 0.0 112.205 -177.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -54.19 -52.88 59.8 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -70.64 -29.6 66.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.989 -1.46 . . . . 0.0 112.114 -173.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -72.04 -58.09 3.73 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.478 0.711 . . . . 0.0 110.847 178.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 53' ' ' PHE . 3.9 mm? -68.2 -11.24 58.95 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.556 -176.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 N--CA 1.484 1.234 0 C-N-CA 123.131 0.572 . . . . 0.0 111.113 167.378 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.949 0.404 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -94.1 -55.03 3.35 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.888 0.851 . . . . 0.0 109.343 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.403 ' O ' HG23 ' A' ' 7' ' ' VAL . 9.9 m-70 -78.21 -9.2 59.1 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.593 -163.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -53.2 -32.48 48.25 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.551 0.74 . . . . 0.0 111.887 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -66.12 -50.64 63.32 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 124.576 1.151 . . . . 0.0 111.074 -177.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.71 -29.58 63.5 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.503 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 3' ' ' HIS . 90.1 t -67.82 -48.28 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.845 0.458 . . . . 0.0 109.995 177.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -70.3 -28.26 65.04 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.542 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 44.0 t30 -63.13 -46.52 86.88 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.326 0.651 . . . . 0.0 109.831 173.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.57 -53.86 42.45 Favored 'Isoleucine or valine' 0 C--N 1.351 0.643 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.258 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.54 -34.8 79.09 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.195 0.31 . . . . 0.0 110.551 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.56 -20.53 71.96 Favored Glycine 0 C--N 1.343 0.963 0 CA-C-O 119.947 -0.363 . . . . 0.0 113.398 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -86.06 -56.9 3.24 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.634 0.774 . . . . 0.0 111.059 173.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.07 -54.0 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.602 1.161 . . . . 0.0 111.141 -173.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 64.6 mt -80.61 -14.53 58.1 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 64.22 62.0 0.87 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.835 1.254 . . . . 0.0 110.863 172.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.635 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 1.7 mm? -86.26 -26.09 25.19 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.3 172.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.43 -83.94 0.14 Allowed Glycine 0 C--N 1.348 1.217 0 O-C-N 124.048 0.843 . . . . 0.0 113.256 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.18 -25.67 14.19 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.641 0.776 . . . . 0.0 111.025 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.635 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.26 -28.03 68.4 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.209 0.603 . . . . 0.0 111.078 -175.388 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.3 pttt -58.76 -34.0 70.91 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.228 0.611 . . . . 0.0 111.369 173.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -90.81 -10.61 42.16 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.98 0.912 . . . . 0.0 111.803 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.5 t -97.51 -7.06 32.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.701 0.401 . . . . 0.0 111.52 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -103.07 147.57 26.8 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 49.8 p -113.82 -172.56 2.11 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.673 0.789 . . . . 0.0 110.653 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.88 -53.46 57.04 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 123.313 0.645 . . . . 0.0 111.658 -178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -69.54 -5.46 24.41 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -77.95 150.42 34.0 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-O 121.014 0.435 . . . . 0.0 110.365 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.408 ' HB ' ' HB2' ' A' ' 33' ' ' ASN . 90.2 t -83.49 151.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.928 -174.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.428 HD12 HD23 ' A' ' 73' ' ' LEU . 95.1 mt -114.82 -62.53 1.59 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.024 0.53 . . . . 0.0 109.614 173.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.444 ' HG ' HD12 ' A' ' 37' ' ' LEU . 3.4 tt -65.61 110.48 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.77 -40.71 2.37 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 116.366 -0.379 . . . . 0.0 112.522 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.408 ' HB2' ' HB ' ' A' ' 29' ' ' VAL . 62.6 t30 -77.63 -40.71 40.96 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.13 0.49 . . . . 0.0 110.54 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.54 HG22 ' H ' ' A' ' 36' ' ' GLU . 39.8 mm -84.51 121.92 75.01 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 175.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.05 -17.42 31.77 Favored 'Trans proline' 0 C--N 1.371 1.744 0 C-N-CA 122.648 2.232 . . . . 0.0 112.155 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 19.5 mm-40 -93.92 -12.53 28.63 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.987 0.915 . . . . 0.0 111.389 -172.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.444 HD12 ' HG ' ' A' ' 31' ' ' LEU . 2.9 tm? -76.92 94.89 4.0 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.509 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 16.6 t70 -132.45 -168.82 2.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.184 0.994 . . . . 0.0 110.005 -171.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.558 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -56.07 -72.92 0.07 Allowed 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 125.988 1.715 . . . . 0.0 114.599 -170.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.414 ' SD ' H311 ' A' ' 84' ' ' PNS . 25.2 mmt -70.45 -21.11 62.83 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 121.165 -0.959 . . . . 0.0 110.845 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.509 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -68.37 -34.62 76.39 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.342 177.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 39' ' ' SER . 34.3 m -70.58 -38.06 72.07 Favored 'Isoleucine or valine' 0 C--N 1.372 1.556 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -59.46 -43.34 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.417 0.627 . . . . 0.0 110.161 176.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.26 -45.94 85.91 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.053 -1.43 . . . . 0.0 111.482 -175.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.74 -33.62 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-O 118.894 -0.574 . . . . 0.0 111.533 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.524 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.5 mt -60.42 -52.25 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 40.1 m -54.18 -46.23 72.31 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 124.646 1.217 . . . . 0.0 110.224 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.404 ' O ' ' HD2' ' A' ' 52' ' ' TYR . . . -59.89 -42.77 94.55 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.073 0.949 . . . . 0.0 112.251 178.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.402 HD11 HG22 ' A' ' 7' ' ' VAL . 3.6 mm? -55.84 -46.82 78.07 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.348 0.659 . . . . 0.0 110.213 175.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.1 mm-40 -56.82 -45.89 82.01 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 124.128 0.892 . . . . 0.0 110.529 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 47' ' ' THR . 67.2 mm-40 -59.09 -64.11 1.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 O-C-N 124.245 0.966 . . . . 0.0 111.281 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.404 ' HD2' ' O ' ' A' ' 48' ' ' ALA . 83.1 m-85 -66.96 -37.46 84.3 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.653 0.781 . . . . 0.0 112.719 -169.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.403 ' HB2' ' CE1' ' A' ' 55' ' ' PHE . 37.6 m-85 -91.65 -6.05 52.82 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 119.35 -0.357 . . . . 0.0 111.797 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 63.11 34.63 13.53 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.298 1.039 . . . . 0.0 111.841 169.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -135.14 -171.98 2.94 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.407 -175.098 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.8 t -135.66 126.21 26.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.42 0.288 . . . . 0.0 110.481 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.3 t -77.53 132.93 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.447 ' O ' HG13 ' A' ' 62' ' ' ILE . 20.5 t70 -71.81 143.72 49.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.04 0.536 . . . . 0.0 110.52 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.7 -41.64 82.12 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.888 0.875 . . . . 0.0 112.1 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -75.56 1.4 14.42 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.918 0.887 . . . . 0.0 112.516 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.92 -11.09 8.99 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.696 0.398 . . . . 0.0 111.43 172.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 58' ' ' ASP . 50.9 mt -82.37 113.86 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.7 t -136.09 175.15 9.87 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.869 0.868 . . . . 0.0 109.216 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.69 76.5 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 170.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -64.89 -21.36 66.8 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.59 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 58.3 m -68.11 -36.74 80.24 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.848 0.459 . . . . 0.0 110.356 177.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.598 ' HA ' HD21 ' A' ' 73' ' ' LEU . 87.2 m-85 -95.67 16.63 16.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.978 0.511 . . . . 0.0 112.305 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -61.88 -46.67 88.38 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.227 0.33 . . . . 0.0 110.88 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.0 p -139.48 163.44 32.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.958 0.903 . . . . 0.0 110.407 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.4 tp -64.93 -31.01 72.04 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.581 0.752 . . . . 0.0 110.909 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.67 -29.54 69.49 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.716 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.0 m -64.1 -52.94 56.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.996 0.519 . . . . 0.0 110.3 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.598 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -59.3 -45.36 91.49 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 123.316 0.385 . . . . 0.0 110.811 177.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.37 87.06 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.195 0.934 . . . . 0.0 111.094 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -61.05 -53.46 56.92 Favored 'General case' 0 C--N 1.352 0.674 0 O-C-N 123.744 0.652 . . . . 0.0 109.809 178.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.482 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.2 m-85 -55.29 -52.65 62.75 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.152 0.908 . . . . 0.0 111.586 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.4 m -65.27 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 123.355 0.409 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.34 -18.65 59.94 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.607 0.363 . . . . 0.0 111.731 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -80.29 -37.86 31.91 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.314 0.506 . . . . 0.0 109.662 171.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.6 mmmt -62.57 -58.32 7.99 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.095 0.958 . . . . 0.0 111.765 -176.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.02 -14.91 62.51 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.105 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.9 m -91.42 -31.2 16.11 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.932 0.493 . . . . 0.0 111.624 176.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 123.683 0.793 . . . . 0.0 109.119 -177.621 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.439 H422 HD11 ' A' ' 46' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.106 0.479 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -96.09 -55.04 3.09 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -70.85 -10.17 59.04 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.226 -1.352 . . . . 0.0 114.125 -165.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.0 -34.64 43.63 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.64 -34.87 67.6 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 120.825 0.345 . . . . 0.0 110.487 -175.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.71 -30.6 56.74 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.63 0.772 . . . . 0.0 110.71 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 95.5 t -67.02 -47.93 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -72.64 -26.0 61.49 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 122.662 0.385 . . . . 0.0 110.717 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.45 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.7 t30 -62.25 -47.55 83.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.158 0.583 . . . . 0.0 109.577 171.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.86 -47.44 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.979 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.63 -38.83 89.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.237 0.615 . . . . 0.0 110.534 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.568 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.84 -19.69 78.3 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.815 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -84.28 -52.06 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.404 0.682 . . . . 0.0 110.975 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.5 t -69.72 -49.28 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.906 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.581 HD11 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -90.89 -6.51 54.07 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.144 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 64.61 65.62 0.63 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.126 0.97 . . . . 0.0 111.298 174.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.568 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 8.8 mp -85.75 -38.81 17.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.62 0.768 . . . . 0.0 110.799 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.68 -90.38 0.56 Allowed Glycine 0 C--N 1.35 1.322 0 O-C-N 123.31 0.381 . . . . 0.0 112.652 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.31 -19.92 16.81 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.903 0.881 . . . . 0.0 110.454 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -64.87 -31.95 73.43 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.459 0.704 . . . . 0.0 109.801 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.8 pttt -68.97 -32.88 72.78 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.793 0.437 . . . . 0.0 110.765 174.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -79.84 -29.75 40.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.171 0.589 . . . . 0.0 110.659 -173.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 t -81.63 -16.28 51.95 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.943 -177.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 pp -95.54 155.92 16.54 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.72 0.295 . . . . 0.0 110.867 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.5 p -117.65 -172.35 2.22 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.263 1.025 . . . . 0.0 111.086 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.21 75.39 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.345 0.658 . . . . 0.0 111.779 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -80.19 3.84 19.41 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.546 0.738 . . . . 0.0 112.266 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.2 t -75.38 136.65 40.77 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.691 0.396 . . . . 0.0 110.408 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.03 147.57 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.7 mt -108.26 -67.78 0.95 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 122.243 -0.286 . . . . 0.0 110.365 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.4 mt -56.73 116.33 3.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.812 0.445 . . . . 0.0 111.07 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.66 -23.43 19.64 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-N 115.331 -0.849 . . . . 0.0 113.807 176.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -77.2 -55.85 5.07 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 170.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 24.8 mm -76.52 118.08 69.04 Favored Pre-proline 0 C--O 1.241 0.634 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 176.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.48 -4.38 14.96 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.541 2.161 . . . . 0.0 112.517 -173.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.535 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 46.7 mm-40 -105.98 -15.85 14.79 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.972 0.909 . . . . 0.0 111.157 -175.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.0 tp -80.36 87.98 5.59 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 110.112 -175.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -99.62 -171.02 1.98 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.934 0.893 . . . . 0.0 111.201 174.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 42' ' ' VAL . 78.0 p -66.12 -53.05 42.69 Favored 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.454 1.101 . . . . 0.0 112.096 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -59.64 -30.52 68.79 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.709 0.766 . . . . 0.0 110.578 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.581 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -69.14 -26.91 65.12 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.634 174.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 39' ' ' SER . 2.2 m -65.8 -38.34 81.99 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.553 HG22 H382 ' A' ' 84' ' ' PNS . 7.5 t -62.61 -47.05 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 CA-C-O 121.259 0.552 . . . . 0.0 110.041 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.67 -51.47 68.65 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.797 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.6 m -68.26 -35.91 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.401 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.553 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -62.31 -45.77 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 54.3 m -57.87 -46.14 85.3 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 124.064 0.853 . . . . 0.0 110.595 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.0 -37.08 86.12 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -57.89 -50.67 72.54 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.236 0.614 . . . . 0.0 109.661 172.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.8 mm-40 -50.55 -51.21 50.02 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.61 1.164 . . . . 0.0 110.78 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' THR . 12.5 mm-40 -65.58 -53.49 41.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.454 -174.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -65.66 -46.24 79.91 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.51 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 2.9 m-85 -91.52 -13.8 31.48 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.628 -175.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 65.65 39.96 4.66 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.448 1.099 . . . . 0.0 111.418 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.51 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -131.94 179.36 6.13 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.686 0.794 . . . . 0.0 110.085 -177.108 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.9 t -130.53 112.22 12.99 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.988 0.18 . . . . 0.0 111.25 175.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.479 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.3 t -70.36 114.08 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.494 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.5 t70 -69.03 147.24 51.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 -168.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.041 0.536 . . . . 0.0 112.408 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.92 -7.97 39.9 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.788 0.835 . . . . 0.0 113.233 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -115.02 -11.66 12.09 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.987 0.515 . . . . 0.0 111.825 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 58' ' ' ASP . 51.9 mt -88.51 125.51 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 120.737 0.303 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.7 t -143.49 176.95 8.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.784 1.234 . . . . 0.0 108.948 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.99 -32.16 73.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.692 0.758 . . . . 0.0 109.38 167.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -69.2 -16.31 63.58 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 114.598 -1.183 . . . . 0.0 111.485 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 88.5 m -74.85 -39.2 61.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.405 0.682 . . . . 0.0 109.699 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.558 ' HA ' HD21 ' A' ' 73' ' ' LEU . 96.4 m-85 -93.96 17.29 12.52 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.848 0.859 . . . . 0.0 112.751 -176.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.08 -46.58 83.66 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 122.135 0.174 . . . . 0.0 110.688 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.1 p -138.35 161.11 37.77 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.44 0.696 . . . . 0.0 111.301 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.6 tp -57.75 -42.66 84.4 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.0 0.92 . . . . 0.0 110.816 175.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.62 -31.08 78.67 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.497 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -63.09 -53.59 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.968 0.507 . . . . 0.0 110.401 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.558 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.9 mm? -57.57 -42.58 83.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.4 0.438 . . . . 0.0 110.119 177.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.558 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.45 -42.45 98.79 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.43 -177.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -48.29 78.26 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.098 0.559 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.531 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 37.2 m-85 -53.59 -54.6 35.27 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 123.733 0.646 . . . . 0.0 110.26 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.51 -25.85 34.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.109 0.563 . . . . 0.0 112.372 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 62.8 mm-40 -56.97 -51.45 69.17 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 169.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -67.3 -30.36 70.19 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.835 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.7 mmmt -64.63 -56.88 11.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.613 0.765 . . . . 0.0 112.226 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.2 -13.37 62.37 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.333 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.6 m -67.2 -38.68 85.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.859 0.463 . . . . 0.0 110.638 169.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 58.1 m80 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 123.271 0.628 . . . . 0.0 110.196 179.081 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.553 H382 HG22 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.414 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.861 0.362 . . . . 0.0 110.173 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.23 -37.55 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.267 1.027 . . . . 0.0 110.467 177.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -70.96 -22.01 62.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -168.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -51.9 -31.74 29.65 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.032 0.933 . . . . 0.0 113.138 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' HG3' ' HE ' ' A' ' 8' ' ' ARG . 37.3 tt0 -75.12 -40.31 59.94 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 122.87 0.468 . . . . 0.0 111.25 -175.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.65 -28.61 64.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.992 0.517 . . . . 0.0 111.03 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.472 HG22 HD11 ' A' ' 49' ' ' LEU . 90.0 t -66.9 -49.24 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 41.8 ptt180 -71.03 -25.12 62.52 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.543 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.2 t30 -61.85 -49.32 76.76 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 123.335 0.654 . . . . 0.0 109.318 173.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.0 mt -60.54 -51.44 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.633 177.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.9 -34.24 77.69 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.224 0.21 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.587 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -72.4 -21.46 79.4 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-O 120.196 -0.224 . . . . 0.0 113.262 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.02 -57.14 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.4 0.68 . . . . 0.0 110.176 176.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 97.1 t -71.11 -47.38 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.741 1.216 . . . . 0.0 110.534 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.43 HD11 HD13 ' A' ' 37' ' ' LEU . 44.1 mt -83.46 -6.5 59.47 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.553 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 63.41 59.91 1.19 Allowed 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.58 1.152 . . . . 0.0 110.916 172.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.7 mp -89.65 -29.61 18.69 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.45 173.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.0 -89.88 0.21 Allowed Glycine 0 C--N 1.351 1.406 0 O-C-N 123.978 0.799 . . . . 0.0 112.31 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -101.17 -18.94 15.95 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.928 0.891 . . . . 0.0 110.857 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.86 -26.93 69.01 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.233 0.613 . . . . 0.0 111.095 -177.411 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.1 pttt -62.87 -34.91 78.36 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 123.246 0.618 . . . . 0.0 111.313 173.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -69.7 -29.1 66.43 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.386 1.074 . . . . 0.0 110.995 -176.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -93.26 -6.57 47.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -174.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -99.34 153.53 18.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 176.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.2 p -112.9 -176.07 2.81 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 111.184 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.95 -50.24 74.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.796 0.838 . . . . 0.0 110.668 173.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.1 m -71.54 -12.48 61.39 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.205 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -69.75 140.93 53.5 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 123.311 0.644 . . . . 0.0 110.168 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 63.6 t -79.37 152.21 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.364 1.066 . . . . 0.0 109.848 -176.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.28 -65.74 1.16 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.437 0.695 . . . . 0.0 109.862 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.1 mt -60.56 111.71 1.7 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.05 0.452 . . . . 0.0 110.703 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 103.03 -30.53 10.23 Favored Glycine 0 C--N 1.333 0.416 0 CA-C-N 115.061 -0.972 . . . . 0.0 112.79 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -79.54 -53.61 6.7 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.005 0.431 . . . . 0.0 110.058 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.441 HG22 ' H ' ' A' ' 36' ' ' GLU . 26.8 mm -87.29 120.82 71.45 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.72 -14.83 33.36 Favored 'Trans proline' 0 C--N 1.372 1.765 0 C-N-CA 122.39 2.06 . . . . 0.0 112.22 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.441 ' H ' HG22 ' A' ' 34' ' ' ILE . 19.6 mm-40 -85.83 -18.23 33.47 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 -174.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.43 HD13 HD11 ' A' ' 15' ' ' LEU . 40.2 tp -83.28 80.18 9.16 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 122.036 0.922 . . . . 0.0 110.272 -175.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -93.8 177.31 6.04 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.976 1.71 . . . . 0.0 109.681 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.711 ' HB3' H282 ' A' ' 84' ' ' PNS . 3.6 m -44.34 -64.11 0.75 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.827 1.251 . . . . 0.0 113.35 170.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.8 mmt -65.92 -26.83 67.78 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 121.512 -0.742 . . . . 0.0 111.236 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.18 -38.32 87.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.286 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 39' ' ' SER . 15.1 m -67.07 -35.06 73.52 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 176.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 t -62.17 -48.49 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 121.688 0.756 . . . . 0.0 110.177 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -59.62 -46.36 89.2 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 113.656 -1.611 . . . . 0.0 112.475 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.7 m -73.67 -30.86 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.127 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.455 HD13 HD13 ' A' ' 62' ' ' ILE . 96.4 mt -63.41 -48.77 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.7 m -55.84 -47.01 77.99 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.421 1.076 . . . . 0.0 110.153 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 -40.67 97.3 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.864 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD11 HG22 ' A' ' 7' ' ' VAL . 2.1 mm? -56.16 -49.91 72.63 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.284 0.564 . . . . 0.0 109.858 175.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -63.53 -38.67 92.0 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.594 -1.185 . . . . 0.0 112.249 -178.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -66.77 -54.57 21.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.406 0.682 . . . . 0.0 111.072 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -57.63 -57.6 12.01 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.788 0.835 . . . . 0.0 111.325 -177.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -82.55 -15.01 53.9 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.204 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 64.0 58.84 1.15 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.854 0.862 . . . . 0.0 111.427 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.472 ' CE2' HG22 ' A' ' 57' ' ' VAL . 8.9 p90 -142.95 -177.69 5.46 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.311 173.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.3 m -131.0 121.19 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.882 0.473 . . . . 0.0 110.311 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.472 HG22 ' CE2' ' A' ' 55' ' ' PHE . 2.1 t -77.69 127.31 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 29.4 t70 -89.83 153.75 20.42 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 122.799 0.44 . . . . 0.0 110.651 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -58.41 -34.29 70.6 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.043 0.937 . . . . 0.0 113.223 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -59.75 -33.76 72.08 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.837 0.855 . . . . 0.0 112.156 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.0 pt-20 -97.99 -15.86 19.91 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.462 0.705 . . . . 0.0 110.822 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.455 HD13 HD13 ' A' ' 46' ' ' ILE . 38.4 mt -83.84 119.7 33.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 123.09 0.556 . . . . 0.0 111.061 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 82.9 p -155.29 -172.0 4.01 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.055 0.942 . . . . 0.0 109.378 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.48 -29.72 69.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.058 0.456 . . . . 0.0 110.38 171.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -67.94 -13.44 62.16 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.832 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.1 m -79.26 -41.47 28.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 0.0 110.105 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.466 ' HA ' HD21 ' A' ' 73' ' ' LEU . 78.6 m-85 -99.31 15.53 25.91 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.254 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.94 -49.6 76.8 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 123.055 0.222 . . . . 0.0 110.904 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 74.5 p -138.14 164.29 29.53 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.534 0.734 . . . . 0.0 110.515 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 tp -62.82 -34.5 77.44 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.205 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.02 -31.91 79.29 Favored Glycine 0 C--N 1.341 0.85 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.399 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -62.57 -53.01 61.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.164 0.586 . . . . 0.0 110.103 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.466 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.48 -41.91 81.63 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 123.357 0.41 . . . . 0.0 110.612 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.558 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.22 -44.95 92.29 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 124.048 0.843 . . . . 0.0 110.891 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.84 -54.95 41.08 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.195 0.998 . . . . 0.0 110.118 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 66.2 m-85 -53.83 -55.87 22.7 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.013 0.82 . . . . 0.0 110.753 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 19.6 m -66.48 -25.98 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 79.3 mm-40 -59.17 -52.67 64.7 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -60.8 -38.99 87.23 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.102 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.515 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -67.93 -52.43 36.23 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.598 0.759 . . . . 0.0 111.606 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.37 -17.96 62.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.989 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -78.59 -34.97 46.4 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.819 0.448 . . . . 0.0 111.059 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m80 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 123.38 0.672 . . . . 0.0 110.039 -175.571 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.711 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -100.99 -21.52 15.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.414 0.686 . . . . 0.0 111.402 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -90.72 -14.84 31.36 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 118.209 -0.901 . . . . 0.0 113.086 -174.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.52 -28.22 43.77 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 118.785 0.721 . . . . 0.0 112.203 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 39.3 tt0 -67.97 -46.84 70.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.764 0.825 . . . . 0.0 110.601 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.61 70.43 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.426 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 89.2 t -66.26 -48.38 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 122.864 0.465 . . . . 0.0 109.788 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 5' ' ' GLU . 37.1 ptt180 -69.08 -26.76 65.1 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 123.533 0.521 . . . . 0.0 110.144 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -61.42 -51.39 68.92 Favored 'General case' 0 C--N 1.351 0.644 0 C-N-CA 123.532 0.733 . . . . 0.0 109.506 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.5 mt -62.73 -49.12 84.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.105 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.84 -45.9 87.44 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.06 0.544 . . . . 0.0 111.047 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.493 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -69.93 -18.42 74.4 Favored Glycine 0 C--N 1.337 0.605 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.442 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -81.14 -53.22 6.57 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 117.293 0.546 . . . . 0.0 110.228 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.65 -49.8 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 124.066 0.946 . . . . 0.0 111.141 -173.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.531 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -82.76 -7.4 59.66 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.892 0.477 . . . . 0.0 111.159 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 t30 62.23 64.03 1.01 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.668 1.187 . . . . 0.0 111.644 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.555 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 9.6 mp -88.66 -31.43 18.52 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.91 170.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.93 -99.62 0.5 Allowed Glycine 0 C--N 1.352 1.431 0 O-C-N 123.552 0.533 . . . . 0.0 113.617 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.15 -23.18 35.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.056 0.943 . . . . 0.0 110.689 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.555 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.56 -30.21 69.78 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 122.944 0.498 . . . . 0.0 111.234 -175.384 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.493 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.1 pttt -65.15 -26.21 68.08 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 120.689 0.281 . . . . 0.0 111.341 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -79.5 -33.74 41.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.265 0.626 . . . . 0.0 110.691 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 t -83.2 -8.59 59.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -173.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.4 pp -96.23 166.78 11.57 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 120.969 0.414 . . . . 0.0 110.524 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 73.3 p -115.1 -178.91 3.48 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.113 0.965 . . . . 0.0 110.335 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.89 -14.94 57.46 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.139 0.576 . . . . 0.0 112.209 174.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.4 t -90.9 8.25 35.99 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.045 0.538 . . . . 0.0 111.587 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 94.1 p -78.87 121.2 24.54 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.62 0.368 . . . . 0.0 110.15 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.02 145.71 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.458 ' HA ' HG12 ' A' ' 34' ' ' ILE . 55.2 mt -101.69 -70.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.6 mt -57.94 114.95 2.56 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 122.954 0.501 . . . . 0.0 111.393 178.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.05 -38.1 3.22 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.121 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -75.92 -51.99 11.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.906 0.482 . . . . 0.0 109.913 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.458 HG12 ' HA ' ' A' ' 30' ' ' LEU . 19.6 mm -79.08 112.23 26.24 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 175.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.34 2.27 8.62 Favored 'Trans proline' 0 C--N 1.369 1.652 0 C-N-CA 122.764 2.309 . . . . 0.0 112.113 -177.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 23.4 mm-40 -97.12 -19.41 18.69 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 123.802 0.841 . . . . 0.0 109.688 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.34 96.86 6.79 Favored 'General case' 0 C--N 1.352 0.697 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -90.77 173.87 7.78 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.801 1.24 . . . . 0.0 109.615 172.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.615 ' O ' HG22 ' A' ' 42' ' ' VAL . 86.6 p -59.21 -49.13 79.01 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.508 0.723 . . . . 0.0 111.081 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.3 mmt -60.51 -31.19 70.26 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.9 -0.5 . . . . 0.0 110.724 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.531 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -69.57 -29.01 66.48 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.346 176.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 39' ' ' SER . 2.3 m -63.8 -37.2 79.09 Favored 'Isoleucine or valine' 0 C--N 1.372 1.584 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.593 HG21 H312 ' A' ' 84' ' ' PNS . 9.8 t -66.92 -47.46 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.174 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.59 -42.78 88.84 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.031 -1.441 . . . . 0.0 112.173 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -75.7 -31.01 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.654 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.578 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.8 mt -59.79 -54.43 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 172.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 37.7 m -51.37 -49.2 61.96 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 124.673 1.233 . . . . 0.0 110.868 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.78 -43.78 98.18 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.014 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -55.59 -47.97 75.61 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.144 0.578 . . . . 0.0 110.333 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -59.4 -43.83 92.91 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.983 0.913 . . . . 0.0 111.241 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' THR . 33.2 mm-40 -65.12 -59.12 4.46 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.597 0.759 . . . . 0.0 111.097 -177.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -67.34 -44.85 78.06 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.554 0.741 . . . . 0.0 112.288 -171.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -82.56 -21.14 35.42 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 119.402 -0.332 . . . . 0.0 111.309 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.7 t70 64.03 64.1 0.77 Allowed 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.261 1.024 . . . . 0.0 110.615 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.02 -174.3 4.93 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.7 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -130.49 119.96 23.41 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.217 0.607 . . . . 0.0 110.698 170.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.2 t -70.72 126.37 30.84 Favored 'Isoleucine or valine' 0 C--N 1.353 0.755 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 165.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.3 t70 -73.54 144.57 46.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 122.564 0.346 . . . . 0.0 110.848 -174.038 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -51.16 -42.66 60.95 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.067 0.947 . . . . 0.0 112.973 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.83 -19.91 63.45 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.798 0.839 . . . . 0.0 112.701 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.2 pt-20 -102.55 -7.4 21.88 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.82 0.448 . . . . 0.0 111.15 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 58' ' ' ASP . 75.4 mt -85.81 105.39 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.7 t -133.16 170.57 15.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.016 0.926 . . . . 0.0 109.599 174.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.72 -32.11 71.38 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.472 0.654 . . . . 0.0 109.996 170.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.74 -12.58 61.38 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.599 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.416 HG22 HD13 ' A' ' 73' ' ' LEU . 42.1 m -74.72 -42.18 58.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.577 ' HA ' HD21 ' A' ' 73' ' ' LEU . 92.2 m-85 -92.72 20.94 5.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.096 0.958 . . . . 0.0 112.31 -176.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.458 ' HG3' HG22 ' A' ' 69' ' ' THR . 7.6 pt-20 -65.14 -45.21 85.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.292 0.237 . . . . 0.0 110.633 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.458 HG22 ' HG3' ' A' ' 68' ' ' GLU . 11.5 t -150.13 158.53 44.25 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.064 0.546 . . . . 0.0 110.873 -179.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 tp -52.33 -40.34 61.8 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.547 1.139 . . . . 0.0 111.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.96 -41.82 96.52 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 114.607 -1.179 . . . . 0.0 111.794 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.425 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 50.5 m -60.1 -50.29 74.3 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.001 0.52 . . . . 0.0 111.035 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.577 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -58.06 -40.17 80.31 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 122.604 0.361 . . . . 0.0 110.395 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.555 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.92 -48.64 80.9 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.308 1.005 . . . . 0.0 110.632 178.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.12 -45.59 87.03 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 124.042 0.937 . . . . 0.0 111.002 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.481 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.5 m-85 -56.71 -57.35 12.79 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.294 177.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.7 m -67.6 -23.11 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.3 mm-40 -57.39 -51.28 70.06 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.48 -51.84 63.88 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.312 -176.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.57 -48.49 79.21 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 0.0 112.451 -171.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -78.1 -16.72 57.74 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.155 -178.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.5 m -89.42 -8.67 52.56 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.82 0.448 . . . . 0.0 111.493 172.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 173.623 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.638 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 121.437 0.637 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -95.1 -46.59 6.73 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.152 171.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -74.83 -17.72 60.56 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 113.549 -1.659 . . . . 0.0 113.507 -164.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.24 -37.72 37.06 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.991 0.916 . . . . 0.0 112.487 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -75.17 -41.1 58.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.712 -174.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.54 66.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.367 0.667 . . . . 0.0 111.414 174.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.7 t -70.46 -50.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.082 0.553 . . . . 0.0 109.536 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -67.08 -27.41 67.34 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.32 -58.56 6.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.011 0.924 . . . . 0.0 109.727 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.405 ' O ' HG23 ' A' ' 14' ' ' VAL . 95.3 mt -61.28 -49.77 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.951 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.12 -41.78 89.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.308 0.643 . . . . 0.0 111.126 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.527 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.61 -19.99 79.69 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 121.556 -0.354 . . . . 0.0 113.42 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -75.73 -48.64 21.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.949 0.5 . . . . 0.0 110.446 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 10' ' ' ILE . 57.3 t -67.47 -48.63 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 123.523 0.729 . . . . 0.0 110.38 -177.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.511 ' HB2' HD13 ' A' ' 17' ' ' LEU . 44.2 mt -84.5 0.04 51.25 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.227 -177.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 66.76 24.84 9.83 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.366 1.066 . . . . 0.0 111.507 170.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.511 HD13 ' HB2' ' A' ' 15' ' ' LEU . 9.6 mp -60.11 -41.31 92.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.222 0.609 . . . . 0.0 110.706 174.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.16 -81.68 0.03 OUTLIER Glycine 0 C--N 1.354 1.546 0 O-C-N 124.196 0.935 . . . . 0.0 114.089 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -87.47 -35.83 18.02 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.026 0.93 . . . . 0.0 110.252 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.09 -28.29 69.98 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.123 0.969 . . . . 0.0 110.904 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.527 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 54.9 pttt -70.33 -31.99 69.53 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.806 0.442 . . . . 0.0 111.864 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -80.02 -31.5 39.6 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.102 0.561 . . . . 0.0 110.726 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.1 t -85.65 -5.88 59.21 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.207 0.603 . . . . 0.0 112.45 -175.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -98.07 155.99 16.87 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.236 0.471 . . . . 0.0 110.084 176.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.8 p -112.94 -175.64 2.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.619 0.767 . . . . 0.0 110.921 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -35.77 76.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.273 0.629 . . . . 0.0 110.944 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.6 m -75.95 -15.8 60.11 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.368 -0.833 . . . . 0.0 112.242 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.9 p -67.82 140.63 56.61 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.859 0.299 . . . . 0.0 110.825 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -84.26 143.06 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 123.782 0.833 . . . . 0.0 109.341 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.428 ' HA ' HG12 ' A' ' 34' ' ' ILE . 49.2 mt -110.35 -70.27 0.82 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.828 0.451 . . . . 0.0 109.873 178.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.01 112.52 1.22 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.393 1.077 . . . . 0.0 110.699 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 -40.47 2.48 Favored Glycine 0 C--N 1.345 1.081 0 O-C-N 123.541 0.526 . . . . 0.0 112.745 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -78.14 -59.07 2.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.262 0.625 . . . . 0.0 110.475 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.456 HG22 ' H ' ' A' ' 36' ' ' GLU . 31.9 mm -76.26 120.28 80.96 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.32 -13.38 35.69 Favored 'Trans proline' 0 C--N 1.37 1.699 0 C-N-CA 122.726 2.284 . . . . 0.0 112.441 -177.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.456 ' H ' HG22 ' A' ' 34' ' ' ILE . 21.8 mm-40 -86.75 -13.92 43.87 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.53 0.732 . . . . 0.0 111.27 -177.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.41 81.7 5.64 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.423 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 17.5 t70 -96.04 170.88 8.97 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.65 1.58 . . . . 0.0 109.92 178.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.725 ' HB3' H282 ' A' ' 84' ' ' PNS . 6.1 m -46.56 -67.81 0.25 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.712 1.205 . . . . 0.0 113.019 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.0 mmm -66.13 -24.07 66.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.801 -0.562 . . . . 0.0 111.501 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.423 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -65.42 -37.06 85.82 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 124.069 0.856 . . . . 0.0 112.251 174.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.627 HG22 ' O ' ' A' ' 39' ' ' SER . 7.7 m -68.7 -37.61 77.77 Favored 'Isoleucine or valine' 0 C--N 1.367 1.347 0 CA-C-N 118.445 0.566 . . . . 0.0 109.776 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -61.18 -45.29 98.88 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.592 0.711 . . . . 0.0 109.374 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.4 -50.14 74.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 113.605 -1.634 . . . . 0.0 113.085 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.7 m -71.82 -30.51 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.619 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -63.48 -50.59 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.3 m -53.24 -48.68 68.01 Favored 'General case' 0 C--N 1.351 0.656 0 O-C-N 124.421 1.076 . . . . 0.0 110.929 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.41 -43.74 98.1 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.115 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -57.13 -46.5 82.63 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.463 0.705 . . . . 0.0 110.59 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.88 -44.64 91.16 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.034 0.934 . . . . 0.0 111.222 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 47' ' ' THR . 37.6 mm-40 -59.31 -61.34 2.7 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.63 0.772 . . . . 0.0 111.353 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -67.3 -51.56 51.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.874 -171.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 m-30 -75.2 -16.26 60.5 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.522 0.329 . . . . 0.0 111.551 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.0 t70 68.12 66.73 0.34 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.268 1.027 . . . . 0.0 110.63 175.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.481 ' CE2' HG22 ' A' ' 57' ' ' VAL . 7.7 p90 -157.01 -170.28 3.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.015 172.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.88 138.66 45.71 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 167.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.481 HG22 ' CE2' ' A' ' 55' ' ' PHE . 2.9 t -89.69 122.69 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 176.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' ILE . 18.0 t70 -87.93 153.79 21.02 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.674 0.79 . . . . 0.0 111.281 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.67 -36.9 67.61 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.548 1.139 . . . . 0.0 112.365 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.35 -33.55 76.23 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.228 1.011 . . . . 0.0 111.844 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -96.87 -20.68 17.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.941 0.496 . . . . 0.0 110.918 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' ASP . 53.7 mt -74.76 124.51 32.61 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 174.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.5 t -146.13 -178.7 6.27 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.39 1.076 . . . . 0.0 108.474 165.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.589 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -64.67 -32.41 74.06 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.401 0.619 . . . . 0.0 109.574 168.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -65.94 -12.28 53.63 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.837 178.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 91.6 m -72.9 -38.17 67.0 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.009 0.523 . . . . 0.0 110.489 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.524 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.6 m-85 -97.75 7.05 47.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.16 -47.85 77.44 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.376 0.422 . . . . 0.0 111.232 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.6 p -135.8 166.33 23.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.964 0.506 . . . . 0.0 110.868 173.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.9 tp -59.57 -38.05 80.11 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.072 174.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.1 -35.08 90.96 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.87 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -62.28 -53.08 60.32 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.012 0.525 . . . . 0.0 110.574 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.524 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -56.43 -43.48 79.46 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.508 0.505 . . . . 0.0 110.071 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.58 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.92 -48.13 82.57 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 124.589 1.18 . . . . 0.0 111.667 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 75' ' ' LEU . 2.4 mm? -66.96 -39.03 87.15 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.423 0.452 . . . . 0.0 110.94 -179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.495 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 24.5 m-85 -57.68 -54.72 43.66 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 176.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.44 -24.38 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.099 0.56 . . . . 0.0 112.051 -178.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.6 mm-40 -57.47 -56.01 27.42 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -60.19 -34.94 74.32 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.546 -174.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 30.9 mmmt -63.85 -56.71 13.33 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.344 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.456 HD22 ' HB2' ' A' ' 80' ' ' LYS . 3.1 mm? -84.22 -13.26 53.15 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -173.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.7 m -102.55 -14.97 16.57 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -175.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.5 p-80 . . . . . 0 N--CA 1.493 1.702 0 CA-C-N 119.02 0.827 . . . . 0.0 110.61 -177.132 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.725 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.453 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.11 -36.22 9.76 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.035 0.934 . . . . 0.0 110.799 177.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -73.83 -17.57 61.05 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -169.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -51.99 -33.04 36.42 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 123.809 0.844 . . . . 0.0 112.581 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 -41.78 63.96 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.205 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.5 -28.95 65.36 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.917 0.487 . . . . 0.0 111.053 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.3 t -67.54 -50.55 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 122.994 0.517 . . . . 0.0 109.927 176.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -67.52 -28.62 67.97 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -60.26 -52.89 63.37 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 123.966 0.791 . . . . 0.0 109.749 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 49' ' ' LEU . 85.7 mt -62.92 -55.33 24.3 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 O-C-N 124.219 0.949 . . . . 0.0 111.492 -178.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.64 -34.65 78.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.742 0.417 . . . . 0.0 111.495 -175.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.478 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -78.91 -20.05 71.46 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-O 119.989 -0.34 . . . . 0.0 113.689 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.18 -48.01 25.63 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.033 0.533 . . . . 0.0 109.705 173.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.434 HG13 ' ND2' ' A' ' 44' ' ' ASN . 71.2 t -70.17 -49.77 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.466 1.106 . . . . 0.0 110.929 -176.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -78.21 -9.26 59.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.427 0.691 . . . . 0.0 111.255 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 66.1 t30 67.02 44.52 1.94 Allowed 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.543 1.137 . . . . 0.0 111.401 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 7.0 mp -72.29 -35.36 68.66 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.54 1.136 . . . . 0.0 110.68 173.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.24 -91.39 0.37 Allowed Glycine 0 C--N 1.346 1.122 0 CA-C-N 115.727 -0.67 . . . . 0.0 113.494 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -97.06 -21.02 17.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.787 0.835 . . . . 0.0 110.754 -177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -61.9 -34.25 75.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.392 0.677 . . . . 0.0 109.893 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 56.9 pttt -68.78 -29.84 68.3 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.224 0.61 . . . . 0.0 111.579 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -75.8 -40.74 54.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.164 0.586 . . . . 0.0 110.313 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -85.87 13.32 7.57 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.215 0.606 . . . . 0.0 112.05 -173.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.6 pp -113.36 163.09 15.29 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 122.011 -0.431 . . . . 0.0 111.206 172.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.9 p -122.81 -173.17 2.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.478 1.111 . . . . 0.0 110.251 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.03 65.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.316 0.646 . . . . 0.0 112.719 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -86.79 0.48 54.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.198 0.599 . . . . 0.0 112.602 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.436 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 97.2 p -73.26 125.68 28.34 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.588 0.355 . . . . 0.0 110.751 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.0 t -76.83 136.22 25.02 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.3 mt -108.6 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.532 0.333 . . . . 0.0 110.229 -175.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.52 117.02 5.64 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.45 -33.12 6.26 Favored Glycine 0 C--N 1.342 0.91 0 CA-C-N 115.855 -0.612 . . . . 0.0 113.151 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -90.54 -44.73 9.38 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.084 0.554 . . . . 0.0 110.983 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.501 HG12 ' HA ' ' A' ' 30' ' ' LEU . 33.7 mm -79.87 120.3 79.46 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -70.72 -13.77 32.54 Favored 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 122.847 2.364 . . . . 0.0 112.927 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.433 ' H ' HG22 ' A' ' 34' ' ' ILE . 8.5 mm-40 -94.11 -11.65 30.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.363 0.665 . . . . 0.0 111.091 -174.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -82.66 88.9 6.69 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' HG13 ' A' ' 42' ' ' VAL . 25.6 t70 -101.63 174.03 6.15 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.309 1.443 . . . . 0.0 108.932 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.652 ' HB3' H282 ' A' ' 84' ' ' PNS . 6.2 m -44.78 -65.33 0.54 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.796 1.238 . . . . 0.0 113.45 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.7 mmm -71.31 -16.68 62.46 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.606 -0.684 . . . . 0.0 111.654 -175.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.82 -33.85 71.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.319 0.648 . . . . 0.0 111.539 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 39' ' ' SER . 2.7 m -68.19 -39.4 81.14 Favored 'Isoleucine or valine' 0 C--N 1.371 1.507 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.9 t -64.85 -43.32 96.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.534 0.683 . . . . 0.0 109.904 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.434 ' ND2' HG13 ' A' ' 14' ' ' VAL . 56.3 t30 -66.02 -39.55 90.32 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.91 -1.496 . . . . 0.0 112.287 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 m -70.38 -39.59 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.036 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 42' ' ' VAL . 92.9 mt -61.4 -43.1 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 CA-C-N 118.257 0.48 . . . . 0.0 110.045 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.468 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 87.8 m -58.86 -45.13 90.84 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.108 175.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.432 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -63.07 -36.75 84.63 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.642 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 10' ' ' ILE . 3.5 mm? -60.35 -40.08 89.45 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.496 0.718 . . . . 0.0 110.103 175.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -57.98 -51.02 71.39 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.005 0.816 . . . . 0.0 110.481 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 47' ' ' THR . 7.5 mm-40 -58.62 -45.1 89.95 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 124.161 0.913 . . . . 0.0 111.473 -173.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.432 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 17.3 m-85 -81.74 -55.98 4.28 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -172.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -83.82 -18.19 38.47 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.0 58.88 2.58 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.339 1.056 . . . . 0.0 111.384 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -129.29 -171.82 2.59 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.431 172.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.1 m -127.8 111.72 13.96 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.628 166.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.1 t -69.47 112.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.358 0.949 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 173.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 32.9 t70 -77.54 151.71 34.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.179 0.592 . . . . 0.0 111.217 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -60.16 -32.94 71.52 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.604 0.761 . . . . 0.0 112.433 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -71.48 -31.85 67.6 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.296 0.638 . . . . 0.0 111.823 -173.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -85.65 -20.54 29.28 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.744 0.418 . . . . 0.0 110.887 -178.256 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 68.1 mt -73.07 124.06 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.26 0.624 . . . . 0.0 111.039 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 86.2 p -147.91 175.99 10.52 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.193 0.997 . . . . 0.0 109.448 166.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.546 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -61.07 -36.14 78.84 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.636 0.731 . . . . 0.0 110.194 169.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -78.75 -8.63 58.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.114 -176.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -70.71 -37.63 73.57 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.628 ' HA ' HD21 ' A' ' 73' ' ' LEU . 55.2 m-85 -97.58 14.71 25.67 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.406 0.682 . . . . 0.0 112.72 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.69 -44.19 96.87 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 0.0 111.0 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 72' ' ' SER . 15.3 t -144.94 162.21 37.44 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.252 0.621 . . . . 0.0 110.428 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.77 -36.85 77.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.106 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.23 -33.86 87.31 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.96 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.407 ' H ' HG23 ' A' ' 69' ' ' THR . 74.4 m -64.67 -53.51 46.31 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 122.89 0.476 . . . . 0.0 110.662 177.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.628 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -59.01 -39.04 80.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.021 0.201 . . . . 0.0 110.477 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.564 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.03 -45.49 86.86 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 124.073 0.858 . . . . 0.0 110.383 176.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.76 -49.76 76.45 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.957 0.903 . . . . 0.0 110.893 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.448 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 72.9 m-85 -61.59 -48.14 82.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.596 0.358 . . . . 0.0 111.037 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 18.2 m -70.17 -26.79 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.512 0.325 . . . . 0.0 111.627 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 77.6 mm-40 -59.37 -51.86 68.11 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -58.69 -37.6 76.43 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 124.097 0.873 . . . . 0.0 112.052 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.0 mmmt -59.76 -54.96 40.17 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.254 0.55 . . . . 0.0 110.853 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.07 -14.01 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.895 -176.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.3 m -90.15 -21.62 22.13 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.678 0.391 . . . . 0.0 111.567 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 . . . . . 0 N--CA 1.483 1.177 0 C-N-CA 123.318 0.647 . . . . 0.0 109.443 -177.829 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.652 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -97.32 -41.77 8.09 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.135 0.969 . . . . 0.0 108.432 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -82.77 -3.91 57.24 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 113.691 -1.595 . . . . 0.0 112.734 -168.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -52.14 -34.32 44.12 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.941 0.897 . . . . 0.0 112.434 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.79 -43.21 63.04 Favored 'General case' 0 C--N 1.352 0.686 0 O-C-N 123.579 0.549 . . . . 0.0 110.355 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.62 -31.96 73.27 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.571 0.348 . . . . 0.0 111.124 176.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 85.1 t -68.53 -46.51 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 122.821 0.448 . . . . 0.0 110.461 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -70.79 -23.12 62.33 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.673 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -63.95 -50.19 69.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.479 HG21 HD22 ' A' ' 49' ' ' LEU . 88.7 mt -61.39 -48.3 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.673 178.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.05 -36.81 85.53 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.052 0.541 . . . . 0.0 110.341 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.532 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.45 -21.05 78.69 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.54 -0.755 . . . . 0.0 113.67 175.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -85.85 -46.01 11.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.952 0.901 . . . . 0.0 111.225 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.7 t -76.86 -55.73 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 123.752 0.821 . . . . 0.0 110.385 -175.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.533 HD11 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -82.93 -9.52 59.26 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.858 -176.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 68.28 63.52 0.36 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.735 1.214 . . . . 0.0 110.796 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.532 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.0 mp -82.01 -36.93 27.3 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.586 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.94 -89.66 0.06 OUTLIER Glycine 0 C--N 1.356 1.688 0 O-C-N 123.632 0.583 . . . . 0.0 113.795 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.94 -40.57 22.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.785 0.834 . . . . 0.0 110.317 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -28.17 63.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.917 1.287 . . . . 0.0 112.298 -170.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.7 4.11 8.45 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -92.16 -46.98 7.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.91 0.484 . . . . 0.0 109.775 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 t -70.48 -29.09 65.54 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.87 -172.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 4.1 pp -84.16 157.42 21.68 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.84 0.456 . . . . 0.0 111.431 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.2 p -137.42 -162.68 1.32 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.357 1.463 . . . . 0.0 108.533 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.83 -23.07 51.04 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.8 m -77.67 -12.02 59.93 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.635 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 35.9 t -62.03 124.74 21.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.742 0.817 . . . . 0.0 111.349 -177.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 67.6 t -74.0 153.97 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 70.9 mt -120.97 -60.11 1.68 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.435 HD23 HD12 ' A' ' 37' ' ' LEU . 33.5 mt -56.73 110.94 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.142 0.577 . . . . 0.0 110.63 169.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.42 -32.56 6.13 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.269 -0.878 . . . . 0.0 113.181 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -76.86 -60.29 2.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.529 0.331 . . . . 0.0 110.18 -179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.519 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 25.1 mm -78.33 116.98 63.46 Favored Pre-proline 0 CA--C 1.542 0.659 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.15 -6.55 18.09 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.324 2.016 . . . . 0.0 112.297 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -97.9 -10.29 24.85 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.69 0.796 . . . . 0.0 111.144 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.8 tm? -79.0 82.81 5.15 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -177.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.425 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 32.0 t70 -101.79 174.34 6.0 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.417 1.487 . . . . 0.0 109.74 176.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.637 ' HB3' H282 ' A' ' 84' ' ' PNS . 0.5 OUTLIER -43.32 -60.52 1.67 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.209 1.404 . . . . 0.0 112.715 166.32 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.9 mmt -60.83 -32.49 71.87 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 121.135 0.493 . . . . 0.0 110.822 -178.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.533 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -68.74 -29.33 67.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.648 176.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 39' ' ' SER . 3.3 m -66.96 -37.68 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.875 0.761 . . . . 0.0 109.171 174.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.458 HG22 H382 ' A' ' 84' ' ' PNS . 4.2 t -67.28 -44.64 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-O 121.543 0.687 . . . . 0.0 109.29 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -58.69 -49.5 77.36 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.059 -1.428 . . . . 0.0 112.532 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -70.35 -39.04 76.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.802 -175.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 89.2 mt -60.15 -46.26 94.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 88.4 m -57.0 -43.32 81.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 124.065 0.853 . . . . 0.0 110.611 174.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.406 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -69.6 -28.19 65.73 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.265 0.626 . . . . 0.0 112.15 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.531 HD12 HG11 ' A' ' 77' ' ' VAL . 3.6 mm? -61.95 -48.11 81.85 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -56.43 -42.83 78.72 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.005 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' THR . 47.3 mm-40 -60.17 -64.34 0.98 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.879 0.872 . . . . 0.0 111.571 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.447 ' HB2' HD11 ' A' ' 10' ' ' ILE . 48.3 m-85 -66.56 -45.78 78.24 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.838 0.711 . . . . 0.0 112.326 -171.014 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -83.94 -21.68 31.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 66.29 57.93 0.72 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.458 1.103 . . . . 0.0 111.025 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -140.58 179.48 6.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.157 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -126.44 114.89 18.77 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.1 p -72.48 145.77 11.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 124.944 1.298 . . . . 0.0 110.918 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.467 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.1 t70 -87.01 142.22 28.09 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 174.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.4 -36.79 74.29 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -176.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -70.19 -15.98 63.01 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.9 pt-20 -86.91 -33.43 19.72 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.647 0.379 . . . . 0.0 110.34 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 42.9 mt -78.99 129.01 38.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.006 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 t -141.76 -177.68 5.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.957 1.303 . . . . 0.0 107.961 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.73 -27.41 67.6 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -64.84 -13.41 55.99 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.371 1.068 . . . . 0.0 111.659 174.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 89.1 m -76.03 -50.25 15.31 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 170.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.459 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 97.5 m-85 -84.2 8.76 14.71 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.2 pt-20 -60.04 -42.97 95.58 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 122.47 0.308 . . . . 0.0 110.907 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.52 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.0 t -150.82 162.53 40.56 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.418 0.628 . . . . 0.0 112.009 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.7 -37.78 82.82 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.506 -1.224 . . . . 0.0 110.754 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.94 -32.46 84.11 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.86 -177.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 54.9 m -70.17 -51.94 27.3 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.265 177.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.41 -46.62 62.98 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.234 0.54 . . . . 0.0 111.105 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -63.68 -39.18 93.69 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.203 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -47.34 83.02 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.953 0.901 . . . . 0.0 109.628 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.464 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 59.1 m-85 -61.78 -43.51 98.7 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.207 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.531 HG11 HD12 ' A' ' 49' ' ' LEU . 29.9 m -72.87 -23.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-O 119.007 -0.521 . . . . 0.0 112.228 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 65.0 mm-40 -56.19 -51.17 69.0 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 167.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 76' ' ' PHE . 90.6 m-70 -54.33 -49.56 69.44 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.286 0.991 . . . . 0.0 111.832 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 28.1 mmmt -68.18 -43.71 77.53 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -171.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.25 -14.9 52.24 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.699 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.2 m -107.97 -11.62 15.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.173 0.589 . . . . 0.0 112.55 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 . . . . . 0 C--O 1.25 1.128 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.668 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.637 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 tpt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -60.76 -36.49 79.07 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.801 0.84 . . . . 0.0 113.026 -166.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' ' 7' ' ' VAL . 2.6 m-70 -73.23 -11.56 60.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 118.187 -0.911 . . . . 0.0 112.282 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.24 -30.83 51.67 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 118.395 0.543 . . . . 0.0 110.879 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.19 -53.14 53.96 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.549 1.14 . . . . 0.0 110.528 -178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.435 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.26 -35.49 79.63 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.393 -0.822 . . . . 0.0 111.252 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -65.82 -51.74 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 O-C-N 123.433 0.458 . . . . 0.0 110.048 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 11' ' ' LEU . 40.9 ptt180 -68.8 -27.0 65.48 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.041 0.536 . . . . 0.0 110.29 -176.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.6 -48.98 79.36 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 123.96 0.788 . . . . 0.0 109.657 173.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.2 mt -63.15 -47.41 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 124.274 0.984 . . . . 0.0 110.932 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 8' ' ' ARG . 52.2 mt -60.3 -42.79 96.28 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.492 0.717 . . . . 0.0 111.025 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.458 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -77.33 -18.78 77.66 Favored Glycine 0 C--N 1.339 0.72 0 CA-C-N 115.742 -0.663 . . . . 0.0 113.202 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.1 -43.31 43.9 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.225 0.512 . . . . 0.0 109.693 174.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 10' ' ' ILE . 88.1 t -71.8 -60.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -83.05 -3.8 57.65 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.621 -170.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 66.61 55.97 0.76 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.792 1.237 . . . . 0.0 111.733 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -84.11 -29.25 26.91 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.964 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.25 -99.54 1.32 Allowed Glycine 0 C--N 1.35 1.343 0 O-C-N 123.542 0.526 . . . . 0.0 112.52 177.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.15 -23.05 18.09 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.826 0.85 . . . . 0.0 110.389 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.518 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.24 -30.86 71.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 0.0 110.421 -175.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 60.0 pttt -62.8 -33.61 75.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.309 0.644 . . . . 0.0 111.806 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -88.71 -18.54 27.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.024 0.529 . . . . 0.0 111.315 -172.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -94.52 -1.53 53.25 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.049 0.54 . . . . 0.0 111.244 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.518 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -99.0 148.12 24.32 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 173.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.5 p -118.39 -171.95 2.18 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.528 0.731 . . . . 0.0 111.173 -170.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.06 -23.47 67.46 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.114 0.565 . . . . 0.0 112.458 178.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.1 t -88.01 -17.05 32.03 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.328 0.651 . . . . 0.0 111.753 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 24' ' ' LEU . 79.0 p -77.33 128.06 33.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.44 0.296 . . . . 0.0 110.214 -178.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.4 t -81.38 143.04 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 124.571 1.149 . . . . 0.0 109.772 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.569 ' HA ' HG12 ' A' ' 34' ' ' ILE . 64.4 mt -102.33 -67.81 0.86 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.397 0.679 . . . . 0.0 110.236 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.601 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.2 tt -57.46 115.74 2.92 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.88 0.872 . . . . 0.0 111.442 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.59 -22.54 7.5 Favored Glycine 0 C--N 1.353 1.479 0 CA-C-N 115.747 -0.661 . . . . 0.0 114.272 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -90.1 -47.18 7.98 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.709 0.804 . . . . 0.0 110.687 -176.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.569 HG12 ' HA ' ' A' ' 30' ' ' LEU . 43.8 mm -75.63 122.16 86.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.07 -8.55 23.92 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.797 2.331 . . . . 0.0 113.288 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.423 ' H ' HG22 ' A' ' 34' ' ' ILE . 58.7 mm-40 -90.49 -28.85 18.29 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 173.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.601 HD12 ' HA ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -74.53 94.26 2.6 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 32.1 t70 -125.74 -166.21 1.53 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 125.246 1.418 . . . . 0.0 107.705 171.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.562 ' HB3' H282 ' A' ' 84' ' ' PNS . 12.9 m -41.82 -69.39 0.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.605 1.562 . . . . 0.0 114.58 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 mmt -70.74 -23.92 62.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.242 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 45' ' ' VAL . . . -60.71 -41.77 95.88 Favored 'General case' 0 C--N 1.345 0.392 0 O-C-N 123.932 0.77 . . . . 0.0 111.405 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -63.13 -42.38 96.33 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.1 t -63.81 -45.6 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.729 0.776 . . . . 0.0 110.354 -176.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -58.23 -47.96 81.88 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.502 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.458 ' O ' HD23 ' A' ' 49' ' ' LEU . 24.8 m -76.01 -25.29 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 119.069 -0.491 . . . . 0.0 112.017 -175.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 42' ' ' VAL . 90.7 mt -62.74 -55.73 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 171.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.7 m -54.98 -46.91 75.14 Favored 'General case' 0 C--N 1.356 0.888 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.795 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.97 89.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.991 0.917 . . . . 0.0 111.621 -177.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -53.89 -43.55 69.75 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.293 0.637 . . . . 0.0 110.071 175.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.478 ' HG2' ' H ' ' A' ' 57' ' ' VAL . 42.9 mt-10 -61.8 -45.4 94.0 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.309 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' THR . 44.1 mm-40 -63.39 -55.18 26.51 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.177 0.591 . . . . 0.0 111.477 -176.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -69.0 -42.06 76.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.147 0.579 . . . . 0.0 112.439 -174.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -82.65 -11.31 58.46 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 66.43 38.02 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.654 1.182 . . . . 0.0 111.69 174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.3 -168.7 1.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.716 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.5 t -133.51 116.99 16.62 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 167.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.478 ' H ' ' HG2' ' A' ' 50' ' ' GLU . 48.0 t -69.75 113.8 6.17 Favored 'Isoleucine or valine' 0 C--N 1.351 0.636 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 173.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.512 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.0 t70 -70.3 148.85 48.02 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.671 0.789 . . . . 0.0 110.784 -173.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -56.97 -41.49 78.44 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.336 0.654 . . . . 0.0 112.491 -176.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.63 -27.29 67.57 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.51 0.724 . . . . 0.0 112.308 -174.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -95.79 -5.42 41.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.241 0.616 . . . . 0.0 111.129 -177.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 58' ' ' ASP . 58.2 mt -83.67 106.82 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 122.735 0.414 . . . . 0.0 110.02 175.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -128.28 173.98 9.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.035 0.934 . . . . 0.0 109.546 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.509 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -67.91 -31.27 70.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.079 0.552 . . . . 0.0 110.149 169.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -67.11 -18.97 65.55 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.396 175.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.5 m -73.68 -37.28 65.28 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.557 ' HA ' HD21 ' A' ' 73' ' ' LEU . 68.1 m-85 -107.83 15.76 24.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.519 0.728 . . . . 0.0 112.196 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.78 -42.69 94.89 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.371 0.419 . . . . 0.0 110.477 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.0 t -146.85 166.18 27.47 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.034 0.534 . . . . 0.0 110.606 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 24' ' ' LEU . 61.9 tp -62.47 -35.48 79.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.071 0.549 . . . . 0.0 110.681 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.24 -32.14 79.6 Favored Glycine 0 C--N 1.351 1.402 0 O-C-N 123.688 0.618 . . . . 0.0 112.72 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.4 m -68.4 -52.65 30.61 Favored 'General case' 0 C--N 1.347 0.5 0 C-N-CA 123.161 0.585 . . . . 0.0 110.469 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.557 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.1 mm? -61.57 -42.24 98.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 117.812 0.278 . . . . 0.0 111.497 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.547 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.46 -46.74 80.22 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.071 0.857 . . . . 0.0 110.248 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -49.66 76.83 Favored 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 124.208 1.003 . . . . 0.0 110.599 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.47 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 18.1 m-85 -60.07 -50.47 73.59 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.52 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.71 -28.89 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.652 0.381 . . . . 0.0 111.695 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 50.2 mm-40 -60.27 -46.79 88.61 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 170.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.27 -29.4 70.49 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.927 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -70.32 -56.61 6.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.101 0.56 . . . . 0.0 111.908 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.21 -14.02 62.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.547 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -82.88 -47.77 11.46 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 122.259 0.224 . . . . 0.0 110.614 170.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.726 -178.425 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.562 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.3 -37.8 8.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.341 1.056 . . . . 0.0 110.841 176.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.442 ' O ' HG23 ' A' ' 7' ' ' VAL . 79.4 m-70 -79.93 -16.5 55.16 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -169.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 2.4 pt? -53.5 -28.67 32.21 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.499 0.59 . . . . 0.0 111.622 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -57.81 -56.54 20.69 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.496 1.518 . . . . 0.0 110.409 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.414 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.41 -28.3 64.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.802 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 3' ' ' HIS . 95.2 t -68.29 -50.6 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.075 0 C-N-CA 122.474 0.31 . . . . 0.0 110.924 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 19.0 ptt85 -70.52 -24.04 62.75 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.415 0.286 . . . . 0.0 110.56 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.14 -48.47 81.46 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.795 170.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 6' ' ' ALA . 81.3 mt -60.48 -57.73 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.936 0.894 . . . . 0.0 111.74 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.46 ' HG ' HG11 ' A' ' 45' ' ' VAL . 9.2 mp -64.31 -34.92 79.25 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 123.083 0.239 . . . . 0.0 110.999 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.567 ' HA3' ' HD2' ' A' ' 21' ' ' LYS . . . -66.51 -34.39 87.55 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-N 116.239 -0.437 . . . . 0.0 113.376 174.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -72.06 -52.05 18.7 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.577 0.751 . . . . 0.0 109.893 -178.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.4 t -66.63 -53.17 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.014 0.926 . . . . 0.0 110.655 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.436 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.6 mm? -87.91 -5.24 58.66 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 65.1 56.02 1.07 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.996 0.903 . . . . 0.0 110.925 174.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.521 HD23 ' HA2' ' A' ' 12' ' ' GLY . 4.3 mm? -70.48 -31.7 68.93 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 178.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 73.89 -98.58 0.98 Allowed Glycine 0 C--N 1.342 0.877 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.334 -178.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.69 -11.74 19.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.953 0.901 . . . . 0.0 111.152 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -72.26 -29.29 63.77 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -178.927 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HD2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -69.15 -10.76 59.23 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 173.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -89.35 -36.94 15.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.116 0.566 . . . . 0.0 110.722 177.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.2 t -76.88 -21.61 54.69 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.647 0.379 . . . . 0.0 111.217 -173.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -86.99 146.84 25.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.8 p -123.72 -169.47 1.95 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.463 1.105 . . . . 0.0 109.218 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.78 72.87 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.611 0.364 . . . . 0.0 110.786 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.8 m -80.78 2.56 25.71 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.627 0.771 . . . . 0.0 112.44 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -95.29 145.57 24.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.84 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -77.95 156.87 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.303 1.041 . . . . 0.0 109.139 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 70' ' ' LEU . 82.5 mt -119.87 -62.98 1.42 Allowed 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.902 -0.499 . . . . 0.0 110.234 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 37' ' ' LEU . 93.8 mt -55.34 112.3 1.07 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.307 0.643 . . . . 0.0 110.984 172.512 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.49 -33.48 4.95 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.017 -0.538 . . . . 0.0 113.328 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.43 -41.31 69.66 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.165 0.586 . . . . 0.0 110.174 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.505 HD12 HD11 ' A' ' 17' ' ' LEU . 20.3 mm -90.35 119.22 69.19 Favored Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 174.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.86 -12.28 32.41 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.685 2.256 . . . . 0.0 112.79 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.406 ' H ' HG22 ' A' ' 34' ' ' ILE . 36.4 mm-40 -93.15 -23.87 18.44 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.169 0.588 . . . . 0.0 111.384 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 31' ' ' LEU . 1.2 tm? -79.46 82.32 5.6 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -176.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.475 ' O ' HG13 ' A' ' 42' ' ' VAL . 17.9 t70 -115.68 -155.34 0.57 Allowed 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 125.081 1.352 . . . . 0.0 108.739 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.606 ' O ' HG22 ' A' ' 42' ' ' VAL . 36.0 t -54.26 -71.7 0.07 Allowed 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.078 1.351 . . . . 0.0 113.991 -169.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.67 -24.08 67.64 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.649 -0.657 . . . . 0.0 112.016 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.453 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -67.87 -37.97 82.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.45 0.7 . . . . 0.0 111.678 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 39' ' ' SER . 6.3 m -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 C--N 1.369 1.456 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 174.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.471 HG21 H312 ' A' ' 84' ' ' PNS . 10.7 t -70.33 -40.49 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.829 -176.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -63.81 -41.22 97.93 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.233 1.013 . . . . 0.0 112.076 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.46 HG11 ' HG ' ' A' ' 11' ' ' LEU . 21.7 m -74.37 -33.06 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.355 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.454 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.8 mt -59.43 -47.28 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 41.5 m -59.18 -43.48 92.16 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.109 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -32.26 73.54 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.679 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.8 -45.58 91.89 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 2.4 mm-40 -57.39 -49.34 76.5 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.617 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 47' ' ' THR . 17.6 mm-40 -67.02 -52.45 42.24 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.465 0.706 . . . . 0.0 111.995 -174.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.66 -60.66 3.33 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.7 0.8 . . . . 0.0 111.718 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -78.02 -17.77 56.68 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.232 0.332 . . . . 0.0 111.43 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 65.6 62.43 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.768 1.227 . . . . 0.0 109.82 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.38 -166.61 2.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.656 176.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.5 m -133.01 113.09 12.4 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 123.204 0.602 . . . . 0.0 109.974 167.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 70.7 t -73.17 108.84 4.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.713 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 167.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 22.9 t70 -63.08 148.91 46.48 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.509 -171.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.3 -32.09 71.94 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.895 0.478 . . . . 0.0 112.0 -175.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -70.19 -27.92 64.89 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.535 0.734 . . . . 0.0 111.533 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.1 pt-20 -92.68 -12.48 31.39 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.183 0.193 . . . . 0.0 110.973 -178.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 58' ' ' ASP . 45.5 mt -84.91 106.94 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 122.92 0.488 . . . . 0.0 110.149 175.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.2 p -130.0 179.68 5.73 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.361 1.064 . . . . 0.0 108.703 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.37 -34.5 78.31 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.014 174.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -67.92 -12.71 61.23 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.314 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -70.65 -40.09 73.25 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.829 0.451 . . . . 0.0 110.603 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.598 ' HB2' ' S44' ' A' ' 84' ' ' PNS . 52.5 m-85 -107.61 18.26 21.66 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 69' ' ' THR . 11.1 pt-20 -61.73 -38.35 87.58 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 72' ' ' SER . 8.3 t -146.24 160.6 41.77 Favored 'General case' 0 C--O 1.25 1.103 0 C-N-CA 123.315 0.646 . . . . 0.0 110.729 175.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.41 ' HA ' HD11 ' A' ' 30' ' ' LEU . 12.5 tp -63.6 -29.62 70.84 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.67 -38.22 95.37 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.992 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.509 ' H ' HG23 ' A' ' 69' ' ' THR . 64.4 m -58.67 -51.53 69.52 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -58.37 -45.48 88.19 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 123.667 0.605 . . . . 0.0 111.194 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.592 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -55.45 -45.45 76.86 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.708 1.255 . . . . 0.0 110.143 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.47 -43.57 85.09 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.724 0.64 . . . . 0.0 111.548 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 21.3 m-85 -54.32 -55.78 25.04 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.5 m -73.39 -24.79 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.148 0.979 . . . . 0.0 112.301 -174.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.0 mm-40 -55.64 -54.95 37.88 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 168.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -69.08 -32.08 71.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.765 -171.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.71 -54.96 41.0 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.23 0.612 . . . . 0.0 110.721 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.401 HD22 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -80.73 -13.55 58.89 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.777 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.2 m -72.01 -31.16 65.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.362 0.265 . . . . 0.0 110.413 170.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 35.1 m170 . . . . . 0 CA--C 1.549 0.924 0 C-N-CA 123.312 0.645 . . . . 0.0 109.416 179.221 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.598 ' S44' ' HB2' ' A' ' 67' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -94.51 -53.96 3.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 122.05 0.929 . . . . 0.0 108.741 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 7' ' ' VAL . 97.6 m-70 -70.8 -17.71 62.76 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.0 -1.909 . . . . 0.0 113.419 -164.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -50.09 -34.35 21.55 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -72.3 -42.37 65.55 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 122.511 0.324 . . . . 0.0 110.617 -176.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.83 -33.88 76.87 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.214 0.605 . . . . 0.0 111.07 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 3' ' ' HIS . 83.9 t -66.66 -50.79 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.153 0.581 . . . . 0.0 109.767 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.9 ptt180 -68.6 -26.83 65.57 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.711 0.404 . . . . 0.0 110.634 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.404 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 32.0 t30 -61.64 -50.01 74.24 Favored 'General case' 0 C--O 1.25 1.09 0 C-N-CA 123.996 0.919 . . . . 0.0 109.758 175.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.19 -50.06 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.719 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.3 mt -58.86 -39.89 82.7 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.433 0.693 . . . . 0.0 111.475 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.452 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -71.98 -28.08 69.29 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-O 119.851 -0.416 . . . . 0.0 113.337 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -75.41 -39.51 58.88 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 117.031 0.415 . . . . 0.0 110.686 175.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.2 t -75.18 -54.29 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.005 0.522 . . . . 0.0 110.493 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.542 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.4 mm? -84.78 1.44 46.7 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.172 0.589 . . . . 0.0 112.072 -176.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 65.82 46.61 2.26 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 122.22 1.009 . . . . 0.0 111.245 170.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 mp -77.52 -34.95 53.88 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.873 172.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.49 -91.24 0.25 Allowed Glycine 0 C--N 1.352 1.455 0 O-C-N 123.912 0.757 . . . . 0.0 113.072 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -92.5 -28.92 16.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.984 0.914 . . . . 0.0 110.657 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.2 OUTLIER -65.54 -24.64 67.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.692 0.797 . . . . 0.0 111.435 -173.492 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.452 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 61.0 pttt -65.18 -27.03 68.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.847 0.459 . . . . 0.0 111.817 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.8 t-80 -92.01 -22.96 19.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.774 0.43 . . . . 0.0 110.877 -175.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.473 HG22 ' HA ' ' A' ' 20' ' ' ARG . 7.2 t -86.15 -1.05 57.06 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.359 0.264 . . . . 0.0 111.187 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -103.64 156.43 17.8 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.956 0.408 . . . . 0.0 110.146 172.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.3 p -121.51 -172.34 2.4 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.216 1.006 . . . . 0.0 110.178 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.3 81.23 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 t -75.18 -3.73 34.7 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.002 0.521 . . . . 0.0 112.194 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.1 t -67.68 137.1 55.29 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.001 0.521 . . . . 0.0 110.498 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -86.7 150.69 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.918 0.887 . . . . 0.0 109.863 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.3 mt -109.02 -66.93 1.01 Allowed 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.5 mt -54.41 121.39 8.21 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.842 0.857 . . . . 0.0 111.264 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.76 -28.56 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 119.533 -0.593 . . . . 0.0 113.809 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -77.71 -66.21 0.87 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.498 0.649 . . . . 0.0 110.021 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.16 119.27 76.81 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.192 -175.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.99 -15.52 36.26 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 122.315 2.01 . . . . 0.0 111.899 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -88.04 -29.26 20.81 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.944 0.898 . . . . 0.0 110.152 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.8 100.57 3.48 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.441 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 27.1 t70 -132.52 -156.83 0.78 Allowed 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 171.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.716 ' O ' HG22 ' A' ' 42' ' ' VAL . 58.0 p -67.46 -54.52 19.5 Favored 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -167.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 97.0 mmm -61.55 -27.52 68.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.691 -1.255 . . . . 0.0 111.263 177.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.542 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -68.24 -33.73 74.93 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.795 175.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.716 HG22 ' O ' ' A' ' 39' ' ' SER . 5.9 m -64.68 -37.62 80.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 118.791 0.723 . . . . 0.0 109.645 175.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.49 -48.15 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 121.499 0.666 . . . . 0.0 109.956 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -60.41 -45.84 92.15 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 113.799 -1.546 . . . . 0.0 112.634 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' HD23 ' A' ' 49' ' ' LEU . 32.6 m -71.05 -31.94 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 119.031 -0.509 . . . . 0.0 111.575 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.424 HD13 HD13 ' A' ' 62' ' ' ILE . 82.3 mt -63.48 -50.57 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -50.91 -48.76 60.52 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.508 1.13 . . . . 0.0 110.922 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.44 -46.82 84.5 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.798 -178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.3 mm? -55.2 -45.23 75.86 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.576 0.75 . . . . 0.0 110.366 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.5 -40.1 96.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.823 0.849 . . . . 0.0 112.05 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -65.48 -52.52 52.27 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.43 0.692 . . . . 0.0 112.139 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.49 -49.48 40.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -176.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -75.45 -16.76 60.3 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.834 0.454 . . . . 0.0 111.755 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.49 46.76 3.2 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.432 1.11 . . . . 0.0 110.273 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.93 -170.78 2.58 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.483 175.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.9 t -126.08 117.14 22.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 166.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.12 108.54 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.76 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.592 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.2 t70 -72.8 144.23 47.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.463 0.705 . . . . 0.0 111.286 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.55 -38.7 64.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.875 0.87 . . . . 0.0 112.626 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -71.6 -21.19 61.89 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.218 0.607 . . . . 0.0 111.99 -172.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 10.8 pt-20 -94.6 -17.39 22.36 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.424 HD13 HD13 ' A' ' 46' ' ' ILE . 76.7 mt -81.05 109.39 15.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 123.185 0.594 . . . . 0.0 110.078 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.3 t -130.11 170.4 14.08 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 164.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.91 76.06 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -63.95 -18.97 64.78 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.498 0.719 . . . . 0.0 112.243 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.6 m -64.47 -38.81 92.3 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.283 0.633 . . . . 0.0 110.097 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.571 ' HA ' HD21 ' A' ' 73' ' ' LEU . 77.3 m-85 -96.17 19.45 11.77 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.34 1.056 . . . . 0.0 112.623 -177.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.64 -48.9 77.36 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 123.091 0.244 . . . . 0.0 110.447 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.6 p -142.05 162.59 35.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.816 0.847 . . . . 0.0 110.395 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 60.9 tp -56.29 -40.32 74.12 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.017 0.927 . . . . 0.0 111.386 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.74 -35.45 92.03 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 114.513 -1.222 . . . . 0.0 112.034 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 m -62.2 -51.03 69.43 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 122.959 0.504 . . . . 0.0 110.483 177.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.571 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.07 -42.56 80.84 Favored 'General case' 0 C--N 1.365 1.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.887 176.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.571 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.74 -43.25 85.24 Favored 'General case' 0 C--O 1.21 -1.018 0 O-C-N 124.686 1.241 . . . . 0.0 110.973 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.87 -51.47 68.07 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.864 0.727 . . . . 0.0 110.791 178.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.529 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 68.5 m-85 -55.69 -49.7 72.25 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 123.668 0.605 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.2 m -72.64 -24.86 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.163 0.585 . . . . 0.0 112.018 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.5 mm-40 -56.82 -53.73 54.53 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 169.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -58.69 -43.24 89.93 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.487 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -53.52 -59.02 5.13 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 124.118 0.886 . . . . 0.0 112.157 -177.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -79.22 -13.89 59.41 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.121 -174.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.2 m -80.33 -10.56 59.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.751 0.42 . . . . 0.0 111.478 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.18 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.711 H301 ' HB2' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -36.71 -47.36 0.66 Allowed 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 115.903 1.816 . . . . 0.0 115.903 -162.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.412 ' O ' HG23 ' A' ' 7' ' ' VAL . 39.1 m-70 -68.48 -25.98 65.25 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.47 -30.78 8.69 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 123.925 0.89 . . . . 0.0 112.776 -179.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.86 -50.58 66.05 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 124.315 1.046 . . . . 0.0 110.797 -176.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.22 -25.7 55.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.882 -179.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 3' ' ' HIS . 70.5 t -67.29 -49.59 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -71.55 -24.46 61.94 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.096 0.558 . . . . 0.0 110.3 -178.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -60.95 -50.26 74.12 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.252 0.621 . . . . 0.0 109.666 171.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.35 -46.86 95.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.481 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.2 mt -62.71 -42.51 99.68 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.01 0.524 . . . . 0.0 110.494 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.586 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -68.17 -22.15 74.23 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.436 -0.802 . . . . 0.0 113.239 178.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -84.3 -47.44 10.75 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.372 0.669 . . . . 0.0 111.504 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.16 -58.24 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.455 0.702 . . . . 0.0 110.447 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.5 mm? -80.76 -14.02 58.46 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.792 0.437 . . . . 0.0 110.605 -175.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 67.16 64.47 0.44 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.338 1.055 . . . . 0.0 109.714 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.492 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 3.6 mm? -79.33 -27.04 42.07 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.386 -0.825 . . . . 0.0 108.904 164.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 64.43 -100.82 0.45 Allowed Glycine 0 C--N 1.354 1.55 0 O-C-N 123.664 0.602 . . . . 0.0 113.636 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -89.09 -23.63 22.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.955 0.902 . . . . 0.0 110.795 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' HD12 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -70.81 -22.6 62.33 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.573 0.749 . . . . 0.0 111.003 -176.41 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 22.8 pttm -63.99 -23.6 67.4 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.138 -0.351 . . . . 0.0 110.927 173.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -80.69 -23.83 39.3 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.364 0.666 . . . . 0.0 111.485 -178.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.4 t -94.43 -15.72 24.03 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -91.27 149.48 21.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 81.4 p -118.4 -169.89 1.79 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.361 1.064 . . . . 0.0 109.36 -177.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.17 63.8 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 122.927 0.491 . . . . 0.0 112.195 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -74.16 -16.53 60.99 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.978 0.911 . . . . 0.0 112.452 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.6 p -66.51 123.11 19.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.03 0.532 . . . . 0.0 111.043 -176.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.5 t -75.98 148.67 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 175.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.411 ' HA ' HG12 ' A' ' 34' ' ' ILE . 74.5 mt -113.83 -67.65 0.98 Allowed 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.076 -0.39 . . . . 0.0 110.145 -178.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.89 111.37 1.14 Allowed 'General case' 0 C--N 1.35 0.625 0 C-N-CA 122.98 0.512 . . . . 0.0 110.926 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 -34.62 4.98 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-N 115.216 -0.902 . . . . 0.0 113.191 178.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -80.76 -45.57 16.82 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.266 0.626 . . . . 0.0 110.856 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 30' ' ' LEU . 23.4 mm -90.67 116.15 65.77 Favored Pre-proline 0 C--O 1.243 0.734 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 177.181 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.15 -4.86 14.71 Favored 'Trans proline' 0 C--N 1.368 1.583 0 C-N-CA 122.446 2.097 . . . . 0.0 112.401 -177.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 14.4 mm-40 -89.26 -18.42 27.05 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.397 0.679 . . . . 0.0 110.151 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 56.9 tp -83.63 87.64 7.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.597 0.713 . . . . 0.0 109.189 -177.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.407 ' N ' ' HB3' ' A' ' 41' ' ' ALA . 29.6 t70 -85.53 173.14 10.42 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.94 1.296 . . . . 0.0 110.287 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.665 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.9 t -49.32 -65.21 0.61 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 125.337 1.455 . . . . 0.0 112.231 169.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.0 mmt -60.88 -23.76 65.44 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.306 -0.871 . . . . 0.0 111.981 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.407 ' HB3' ' N ' ' A' ' 38' ' ' ASP . . . -73.14 -28.39 62.22 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.665 HG22 ' O ' ' A' ' 39' ' ' SER . 4.3 m -66.16 -37.53 79.95 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.494 HG21 H312 ' A' ' 84' ' ' PNS . 3.0 t -67.0 -39.45 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.85 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -59.66 -47.4 85.76 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.756 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.48 -30.46 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.753 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.5 HD13 HD13 ' A' ' 62' ' ' ILE . 97.0 mt -64.5 -48.19 86.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.7 m -58.74 -44.71 90.57 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.267 0.979 . . . . 0.0 110.532 177.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.97 89.35 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.129 178.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -58.2 -45.77 87.0 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.146 0.578 . . . . 0.0 109.635 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.5 mm-40 -51.5 -49.25 62.24 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 124.325 1.015 . . . . 0.0 110.037 175.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 47' ' ' THR . 25.4 mm-40 -62.1 -66.32 0.56 Allowed 'General case' 0 C--N 1.353 0.727 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.695 -173.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -70.6 -37.14 73.85 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -168.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -88.33 -14.84 37.21 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.325 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 63.79 46.12 4.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.28 1.032 . . . . 0.0 111.548 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.515 ' CZ ' HG22 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -141.52 -171.94 3.42 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.316 -179.46 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 t -126.0 130.91 52.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 122.918 0.487 . . . . 0.0 110.149 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.515 HG22 ' CZ ' ' A' ' 55' ' ' PHE . 2.6 t -86.31 118.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 172.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 27.0 t70 -76.08 144.8 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.4 0.68 . . . . 0.0 111.838 -170.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -55.22 -40.06 70.4 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.131 0.973 . . . . 0.0 113.377 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.34 -32.32 68.41 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.276 0.631 . . . . 0.0 112.068 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.4 pt-20 -85.96 -23.62 26.85 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.5 HD13 HD13 ' A' ' 46' ' ' ILE . 68.9 mt -72.25 110.12 5.05 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t -139.76 175.82 9.25 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 171.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.9 71.61 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -63.97 -21.4 66.47 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.143 0.977 . . . . 0.0 112.26 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.451 HG22 HD13 ' A' ' 73' ' ' LEU . 20.7 m -81.97 -41.13 21.21 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.189 0.595 . . . . 0.0 110.17 175.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.508 ' HA ' HD21 ' A' ' 73' ' ' LEU . 61.9 m-85 -101.02 7.25 43.57 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.573 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -62.33 -41.24 98.39 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.948 0.499 . . . . 0.0 111.426 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.573 HG22 ' HG3' ' A' ' 68' ' ' GLU . 7.1 t -148.6 154.76 40.17 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.518 0.727 . . . . 0.0 110.052 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.2 tp -56.21 -33.02 64.94 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.201 1.0 . . . . 0.0 111.604 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.18 -43.25 99.64 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.531 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -61.88 -44.14 97.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.968 0.507 . . . . 0.0 111.05 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.5 mm? -59.01 -47.57 84.71 Favored 'General case' 0 C--N 1.363 1.166 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.612 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -53.41 -52.86 58.01 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 124.624 1.203 . . . . 0.0 110.031 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.1 -45.15 93.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.11 0.964 . . . . 0.0 112.224 -174.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.462 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.7 m-85 -60.44 -49.89 75.77 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.256 0.222 . . . . 0.0 110.867 177.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.2 m -71.39 -23.84 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 122.521 0.329 . . . . 0.0 111.132 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 81.8 mm-40 -56.86 -50.48 72.33 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -57.79 -47.96 81.07 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.108 0.88 . . . . 0.0 110.733 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.6 mmmt -62.7 -55.01 30.71 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.209 -172.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.69 -12.24 60.95 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.511 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 52.6 m -89.51 -27.17 20.49 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 123.057 0.543 . . . . 0.0 111.49 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.009 -179.224 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.57 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mpp? . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.767 0.318 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -92.25 -45.59 8.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.289 1.042 . . . . 0.0 108.216 176.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -79.48 -9.84 59.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 113.498 -1.683 . . . . 0.0 113.597 -164.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -53.13 -30.27 35.86 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.632 0.651 . . . . 0.0 112.341 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.68 -51.67 61.26 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.048 0.939 . . . . 0.0 110.793 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.56 -35.55 75.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.429 -177.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.2 t -63.91 -50.34 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 122.923 0.489 . . . . 0.0 109.814 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -67.88 -28.65 67.7 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.773 0.429 . . . . 0.0 110.461 -177.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -61.89 -48.77 79.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.656 0.782 . . . . 0.0 109.881 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.5 mt -59.13 -55.24 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.191 0.996 . . . . 0.0 110.995 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.37 -45.2 88.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.116 -174.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.37 -19.48 79.83 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 116.265 -0.425 . . . . 0.0 113.536 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.8 -38.33 58.29 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.983 0.391 . . . . 0.0 110.104 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -75.29 -56.43 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.529 0.732 . . . . 0.0 110.37 -178.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.431 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.4 mm? -81.75 2.19 31.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.513 0.725 . . . . 0.0 112.031 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.6 34.49 2.72 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.434 1.093 . . . . 0.0 111.897 168.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HG ' ' HD2' ' A' ' 20' ' ' ARG . 6.0 mp -68.12 -33.71 75.01 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.872 0.869 . . . . 0.0 111.256 177.444 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.26 -95.13 0.57 Allowed Glycine 0 C--N 1.351 1.411 0 O-C-N 123.463 0.477 . . . . 0.0 113.095 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -96.33 -24.7 16.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.0 0.92 . . . . 0.0 110.434 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.1 OUTLIER -61.68 -28.74 69.61 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.424 0.69 . . . . 0.0 111.423 -176.103 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.2 pttt -65.98 -26.25 67.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.376 0.67 . . . . 0.0 112.224 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -96.73 -20.93 17.88 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.272 0.629 . . . . 0.0 110.998 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.526 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.1 t -87.2 4.96 40.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.769 0.427 . . . . 0.0 111.38 179.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -107.69 169.87 8.33 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.376 0.67 . . . . 0.0 109.684 171.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.5 p -127.18 -171.38 2.4 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 0.0 109.56 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.74 -31.54 70.86 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.907 0.483 . . . . 0.0 112.016 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -73.4 -4.93 36.58 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -71.6 129.74 39.46 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.03 0.532 . . . . 0.0 110.835 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.405 ' HB ' ' HB2' ' A' ' 33' ' ' ASN . 59.2 t -73.63 155.33 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 124.409 1.083 . . . . 0.0 108.72 171.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 27.3 mt -124.59 -67.13 0.93 Allowed 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 68' ' ' GLU . 5.2 tt -64.96 110.86 2.6 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 172.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.98 -32.13 7.83 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 123.477 0.486 . . . . 0.0 112.73 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.405 ' HB2' ' HB ' ' A' ' 29' ' ' VAL . 53.7 t-20 -84.31 -65.41 1.01 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.78 0.832 . . . . 0.0 110.434 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.424 HG22 ' H ' ' A' ' 36' ' ' GLU . 27.4 mm -71.86 118.12 63.96 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.527 -171.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.92 -4.13 14.85 Favored 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 122.559 2.173 . . . . 0.0 112.442 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 37.7 mm-40 -99.32 -10.24 22.56 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.318 1.047 . . . . 0.0 111.045 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -78.29 82.95 4.56 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.463 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 25.3 t70 -91.85 169.63 10.53 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.587 1.555 . . . . 0.0 110.439 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.573 ' O ' HG22 ' A' ' 42' ' ' VAL . 45.9 t -44.25 -65.73 0.48 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 126.508 1.923 . . . . 0.0 112.637 170.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.4 mmm -68.03 -21.73 65.0 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.896 -0.503 . . . . 0.0 111.522 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.463 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -74.49 -23.87 58.93 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 118.273 -0.87 . . . . 0.0 112.053 174.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' SER . 2.9 m -67.96 -39.55 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 171.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 t -63.35 -44.46 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.162 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.06 -44.37 96.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.306 -1.316 . . . . 0.0 112.887 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -74.2 -30.37 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-O 119.318 -0.373 . . . . 0.0 111.595 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.519 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -61.56 -55.86 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.46 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.9 m -56.12 -39.83 72.82 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 124.629 1.206 . . . . 0.0 111.369 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.403 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -64.69 -46.01 84.19 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.767 0.827 . . . . 0.0 111.69 178.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.403 HD22 HG21 ' A' ' 10' ' ' ILE . 3.5 mm? -54.96 -44.8 74.7 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.328 0.651 . . . . 0.0 110.244 174.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 10.2 mm-40 -53.72 -50.02 66.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.524 1.129 . . . . 0.0 111.447 176.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.6 mm-40 -64.84 -55.8 17.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.542 0.737 . . . . 0.0 111.954 -174.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.403 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 56.5 m-85 -62.6 -56.02 21.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.365 0.666 . . . . 0.0 111.954 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.39 -9.74 59.66 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.2 t70 67.15 35.4 4.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 124.502 1.121 . . . . 0.0 111.106 169.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -173.6 3.44 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.262 0.625 . . . . 0.0 110.772 -171.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.4 m -128.9 113.43 15.22 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.382 0.673 . . . . 0.0 111.362 172.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.74 118.3 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 164.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.591 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 20.7 t70 -72.28 145.88 47.57 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.175 0.443 . . . . 0.0 109.98 -174.208 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.46 -25.98 67.75 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 121.706 -0.621 . . . . 0.0 112.468 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -76.44 -7.2 54.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.952 0.501 . . . . 0.0 112.071 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.9 pt-20 -111.29 -20.25 12.36 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.825 0.45 . . . . 0.0 110.575 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 58' ' ' ASP . 56.3 mt -77.69 114.58 18.38 Favored 'Isoleucine or valine' 0 C--N 1.357 0.928 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 175.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.417 ' O ' ' S44' ' A' ' 84' ' ' PNS . 88.6 p -131.75 177.22 7.69 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.676 1.191 . . . . 0.0 108.127 168.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.04 73.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.676 0.75 . . . . 0.0 109.756 171.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -69.79 -11.37 60.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.261 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -80.14 -40.46 27.34 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 122.797 0.439 . . . . 0.0 110.023 173.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.676 ' HA ' HD21 ' A' ' 73' ' ' LEU . 37.7 m-85 -99.31 14.03 31.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.548 0.339 . . . . 0.0 111.775 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 11.4 pt-20 -60.95 -40.39 93.11 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 123.786 0.679 . . . . 0.0 112.0 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.2 m -151.82 150.11 29.76 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.096 0.958 . . . . 0.0 109.796 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 tp -53.54 -42.75 67.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.125 0.97 . . . . 0.0 111.861 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.78 -38.23 91.7 Favored Glycine 0 C--N 1.341 0.822 0 O-C-N 124.534 1.146 . . . . 0.0 112.251 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m -58.79 -53.52 57.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.217 0.607 . . . . 0.0 110.268 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.676 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.26 -39.01 91.48 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.385 0.274 . . . . 0.0 110.816 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.611 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.8 -46.23 91.32 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 124.493 1.121 . . . . 0.0 110.334 -177.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -65.07 -44.39 89.11 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.885 0.741 . . . . 0.0 110.883 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.474 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 15.9 m-85 -56.61 -46.9 80.65 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.73 0.412 . . . . 0.0 111.06 179.071 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.8 m -75.3 -24.63 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 122.832 0.453 . . . . 0.0 111.596 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.5 mm-40 -57.53 -43.58 84.47 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 169.036 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -67.07 -55.88 12.41 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.211 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -63.82 -54.21 38.63 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.698 0.799 . . . . 0.0 112.235 -168.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.82 -17.63 63.4 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m -97.2 -33.34 11.51 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.655 0.382 . . . . 0.0 111.191 177.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 . . . . . 0 C--O 1.249 1.06 0 C-N-CA 123.979 0.912 . . . . 0.0 109.113 -173.42 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.478 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.695 0.283 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -99.02 -50.98 3.99 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.58 0.752 . . . . 0.0 111.074 172.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -82.09 0.31 41.2 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.664 -171.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -55.38 -34.76 64.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 123.53 0.519 . . . . 0.0 111.771 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -68.52 -45.01 73.36 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.834 0.709 . . . . 0.0 110.593 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.79 -33.73 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.096 0.559 . . . . 0.0 111.03 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.5 t -66.84 -49.95 69.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 122.872 0.469 . . . . 0.0 109.772 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HG3' ' NZ ' ' A' ' 21' ' ' LYS . 36.3 ptt180 -70.8 -22.18 62.39 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.172 0.589 . . . . 0.0 110.877 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -65.05 -52.89 53.25 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.58 0.752 . . . . 0.0 109.57 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.64 -44.62 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.948 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 65.2 mt -63.38 -44.12 95.65 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.697 0.76 . . . . 0.0 110.277 175.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.557 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -66.72 -19.18 69.06 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 114.665 -1.152 . . . . 0.0 113.582 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -90.83 -52.73 4.72 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.243 0.617 . . . . 0.0 110.788 176.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 84.7 t -68.42 -47.24 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.981 0.912 . . . . 0.0 110.815 -173.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.654 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -83.75 -14.29 51.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.768 0.427 . . . . 0.0 110.791 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 63.26 62.72 0.96 Allowed 'General case' 0 C--N 1.355 0.825 0 C-N-CA 124.446 1.099 . . . . 0.0 110.286 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.557 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 10.0 mp -72.88 -34.34 66.64 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 114.915 -1.038 . . . . 0.0 109.2 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.35 -94.61 0.27 Allowed Glycine 0 C--N 1.353 1.492 0 O-C-N 123.908 0.755 . . . . 0.0 112.418 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -92.95 -18.49 22.67 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.521 0.728 . . . . 0.0 110.614 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.457 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.4 -31.43 72.53 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.731 0.412 . . . . 0.0 110.19 -178.381 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.403 ' NZ ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -70.0 -26.23 63.97 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.763 0.425 . . . . 0.0 111.823 174.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -70.58 -48.4 55.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 20' ' ' ARG . 8.2 t -77.42 -7.21 55.79 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.784 -167.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.644 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 3.9 pp -103.22 157.2 17.17 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.679 0.392 . . . . 0.0 111.179 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 76.2 p -114.57 -169.54 1.56 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.327 1.051 . . . . 0.0 109.472 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.0 69.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.146 0.578 . . . . 0.0 111.35 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -69.54 -12.74 61.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.843 0.857 . . . . 0.0 112.847 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.644 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 46.0 t -59.21 134.56 57.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.972 0.909 . . . . 0.0 111.856 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -83.71 146.15 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.512 ' HA ' HG12 ' A' ' 34' ' ' ILE . 66.7 mt -114.27 -72.65 0.69 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.908 0.483 . . . . 0.0 110.642 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.35 113.36 2.87 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.23 -31.42 8.72 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-N 115.753 -0.658 . . . . 0.0 113.053 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -87.81 -57.61 2.88 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.838 0.455 . . . . 0.0 110.583 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.512 HG12 ' HA ' ' A' ' 30' ' ' LEU . 17.6 mm -71.74 119.82 76.44 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.45 -16.86 30.75 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.279 1.986 . . . . 0.0 111.807 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.435 ' H ' HG22 ' A' ' 34' ' ' ILE . 33.4 mm-40 -86.88 -21.33 26.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.491 0.717 . . . . 0.0 110.902 -177.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -74.39 86.1 2.0 Allowed 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -98.8 173.73 6.73 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.282 1.433 . . . . 0.0 109.731 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.655 ' HB3' H282 ' A' ' 84' ' ' PNS . 1.4 m -46.13 -64.52 0.73 Allowed 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 125.154 1.382 . . . . 0.0 113.22 169.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.7 mmt -63.71 -27.48 69.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 121.189 0.519 . . . . 0.0 110.928 -176.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -64.95 -35.96 82.84 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.583 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 39' ' ' SER . 3.7 m -66.47 -36.04 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-N 118.469 0.577 . . . . 0.0 109.644 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.451 HG22 H382 ' A' ' 84' ' ' PNS . 8.0 t -64.85 -47.37 88.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 CA-C-O 121.391 0.615 . . . . 0.0 109.9 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -58.72 -46.09 88.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.185 -1.371 . . . . 0.0 112.954 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.1 -33.45 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.977 -0.535 . . . . 0.0 111.722 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 78.8 mt -62.79 -51.55 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 67.6 m -52.25 -44.52 64.93 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.639 1.212 . . . . 0.0 110.95 177.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.67 -48.89 79.78 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.755 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.5 -46.05 66.48 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.684 0.794 . . . . 0.0 110.592 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 5.8 mm-40 -56.34 -47.86 77.92 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.462 1.105 . . . . 0.0 111.05 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 47' ' ' THR . 24.0 mm-40 -65.28 -52.24 55.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.662 0.785 . . . . 0.0 111.736 -176.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -71.2 -38.25 72.06 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.8 -171.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -94.02 -8.08 40.91 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.776 0.43 . . . . 0.0 111.893 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 67.36 28.23 7.91 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.594 1.158 . . . . 0.0 111.963 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -126.17 -177.67 4.04 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.219 0.608 . . . . 0.0 111.09 -171.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.5 m -127.14 121.1 30.45 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.81 0.844 . . . . 0.0 110.959 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.43 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 10.8 t -74.66 134.4 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.555 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.2 t70 -76.18 137.72 40.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.869 0.467 . . . . 0.0 109.911 -176.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.28 -39.05 81.71 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.345 0.658 . . . . 0.0 112.104 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.13 -4.51 41.96 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.542 0.737 . . . . 0.0 112.746 -172.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -100.97 -31.76 10.96 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 58' ' ' ASP . 35.4 mt -70.43 111.96 4.8 Favored 'Isoleucine or valine' 0 C--N 1.354 0.781 0 CA-C-O 121.261 0.553 . . . . 0.0 110.568 -176.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 42.2 t -112.27 171.96 7.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.65 1.18 . . . . 0.0 108.414 169.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.1 -30.05 68.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 167.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -71.98 -10.37 59.68 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.055 0.942 . . . . 0.0 111.542 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.429 HG22 HD13 ' A' ' 73' ' ' LEU . 96.3 m -69.25 -33.16 72.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.596 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.8 m-85 -89.36 11.49 18.96 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 69' ' ' THR . 9.8 pt-20 -58.76 -47.42 84.74 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 118.084 0.402 . . . . 0.0 110.792 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' GLU . 62.7 p -140.18 162.63 34.79 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.508 0.723 . . . . 0.0 111.125 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.71 -42.46 93.1 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 124.056 0.943 . . . . 0.0 110.924 176.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.99 -27.4 70.33 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 124.476 1.11 . . . . 0.0 112.616 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.7 m -67.67 -52.46 37.69 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 122.729 0.412 . . . . 0.0 110.754 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -60.81 -38.24 84.72 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 117.788 0.267 . . . . 0.0 110.769 176.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.01 63.11 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 124.344 1.027 . . . . 0.0 110.049 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.25 -44.91 92.36 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 123.967 0.792 . . . . 0.0 110.483 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.513 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 6.5 m-85 -58.62 -55.83 30.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.207 0.603 . . . . 0.0 111.512 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.8 m -66.67 -27.36 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.412 0.285 . . . . 0.0 111.39 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.57 -28.26 63.72 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.051 0.54 . . . . 0.0 111.036 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 63.2 m170 -73.45 -38.16 65.57 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.753 0.421 . . . . 0.0 110.169 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -69.54 -54.07 15.93 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.887 0.875 . . . . 0.0 112.238 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.68 -14.47 60.35 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.958 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 51.5 m -95.61 -33.12 12.49 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 118.078 0.399 . . . . 0.0 110.559 174.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 57.6 m80 . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 124.02 0.928 . . . . 0.0 109.246 -176.936 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.655 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -97.99 -36.91 9.98 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.356 0.662 . . . . 0.0 110.869 177.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -77.89 -14.2 59.63 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-O 118.541 -0.742 . . . . 0.0 112.948 -167.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -51.89 -34.0 39.32 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 123.439 0.695 . . . . 0.0 112.068 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.49 -49.83 69.83 Favored 'General case' 0 C--N 1.352 0.715 0 C-N-CA 124.196 0.998 . . . . 0.0 110.671 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.64 -25.2 60.17 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.501 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.3 t -69.15 -48.83 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.634 0.373 . . . . 0.0 110.051 176.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 38.9 ptt180 -69.82 -25.58 63.83 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.52 0.328 . . . . 0.0 110.305 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -65.19 -47.42 77.01 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 123.577 0.548 . . . . 0.0 109.625 173.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 49' ' ' LEU . 75.3 mt -61.22 -57.75 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.75 0.82 . . . . 0.0 111.428 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.546 HD22 HD13 ' A' ' 30' ' ' LEU . 9.9 mp -66.26 -29.61 69.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.626 0.37 . . . . 0.0 110.59 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.474 ' HA2' HD23 ' A' ' 17' ' ' LEU . . . -66.7 -29.07 74.15 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 119.912 -0.382 . . . . 0.0 113.003 172.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.18 -48.63 17.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.44 0.696 . . . . 0.0 110.557 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 10' ' ' ILE . 59.6 t -66.58 -56.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.526 0.731 . . . . 0.0 110.293 -174.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.546 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -84.54 -2.37 57.24 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.95 0.5 . . . . 0.0 110.982 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 58.0 t30 60.77 50.88 5.13 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.636 1.174 . . . . 0.0 111.533 170.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.496 HD11 HG23 ' A' ' 34' ' ' ILE . 2.7 mm? -72.69 -34.05 66.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.943 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.67 -90.7 0.25 Allowed Glycine 0 C--N 1.348 1.223 0 O-C-N 123.486 0.491 . . . . 0.0 112.772 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -94.01 -23.16 18.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.622 0.769 . . . . 0.0 111.012 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.0 OUTLIER -68.32 -29.13 67.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.916 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' O ' ' HD2' ' A' ' 8' ' ' ARG . 9.5 pttm -69.89 -29.89 67.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.453 0.301 . . . . 0.0 111.017 173.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -75.52 -35.49 60.73 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.181 0.592 . . . . 0.0 110.775 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.2 t -83.49 -22.33 32.55 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.938 0.495 . . . . 0.0 111.67 -174.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -82.45 143.77 30.92 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.4 p -118.98 -174.47 2.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.765 1.226 . . . . 0.0 110.225 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.41 88.8 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.292 0.567 . . . . 0.0 111.213 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 m -84.57 3.85 34.84 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.859 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.0 t -95.31 151.31 19.37 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.676 0.79 . . . . 0.0 110.16 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -87.14 148.79 4.38 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.162 1.385 . . . . 0.0 110.183 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.546 HD13 HD22 ' A' ' 11' ' ' LEU . 70.3 mt -114.72 -68.46 0.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.278 0.631 . . . . 0.0 109.737 175.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.66 112.54 2.29 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.518 0.727 . . . . 0.0 109.256 176.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.37 -40.38 2.5 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 123.615 0.572 . . . . 0.0 112.292 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -83.12 -34.64 26.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.382 0.673 . . . . 0.0 110.835 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.496 HG23 HD11 ' A' ' 17' ' ' LEU . 34.7 mm -87.97 117.16 68.13 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 173.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.27 0.27 10.16 Favored 'Trans proline' 0 C--N 1.369 1.623 0 C-N-CA 122.711 2.274 . . . . 0.0 112.562 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.47 ' H ' HG22 ' A' ' 34' ' ' ILE . 10.9 mm-40 -95.08 -18.03 21.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.909 0.884 . . . . 0.0 109.947 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -81.45 92.54 6.47 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -107.12 -164.75 1.01 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.192 0.997 . . . . 0.0 111.068 176.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.581 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.0 t -49.6 -69.3 0.12 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.294 1.838 . . . . 0.0 112.953 176.238 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.8 mmm -68.84 -19.06 64.25 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.895 -0.503 . . . . 0.0 111.233 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -65.82 -43.3 89.0 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-O 118.706 -0.664 . . . . 0.0 111.538 174.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 39' ' ' SER . 4.5 m -61.43 -38.22 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.542 HG21 H312 ' A' ' 84' ' ' PNS . 7.4 t -66.38 -47.33 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.964 -176.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -61.51 -40.47 94.72 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.017 -1.447 . . . . 0.0 112.445 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.411 ' O ' HD23 ' A' ' 49' ' ' LEU . 31.0 m -77.38 -31.22 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.13 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.8 mt -61.76 -54.05 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 71.7 m -58.62 -39.5 80.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 124.807 1.317 . . . . 0.0 111.357 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -48.1 83.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.601 0.76 . . . . 0.0 111.195 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 10' ' ' ILE . 3.8 mm? -53.73 -46.32 70.81 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.432 0.693 . . . . 0.0 110.496 174.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.2 mm-40 -55.03 -46.82 75.31 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 124.172 0.92 . . . . 0.0 111.016 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' THR . 16.0 mm-40 -70.5 -52.16 23.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.109 -174.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -68.93 -35.03 76.33 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -97.48 -6.58 33.44 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 64.34 36.9 8.8 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.329 1.052 . . . . 0.0 112.076 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -132.83 -175.48 3.79 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.711 0.404 . . . . 0.0 110.642 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.76 127.64 33.2 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 122.626 0.37 . . . . 0.0 110.917 172.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.22 129.9 36.68 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.429 ' O ' HG13 ' A' ' 62' ' ' ILE . 21.5 t70 -77.16 148.52 35.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.101 0.56 . . . . 0.0 110.37 -175.044 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.48 -43.21 71.53 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.137 0.975 . . . . 0.0 112.288 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.87 -12.06 61.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.838 0.855 . . . . 0.0 113.015 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -107.47 -15.74 14.54 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 117.918 0.326 . . . . 0.0 110.909 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 58' ' ' ASP . 52.3 mt -74.98 106.53 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 173.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.8 t -126.48 171.28 11.18 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.634 1.173 . . . . 0.0 109.346 173.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -70.08 -26.7 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 121.137 0.494 . . . . 0.0 109.95 168.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -70.37 -10.7 59.77 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.053 0.941 . . . . 0.0 111.488 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.465 HG22 HD13 ' A' ' 73' ' ' LEU . 56.1 m -72.46 -38.1 68.33 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.907 0.483 . . . . 0.0 109.802 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.593 ' HA ' HD21 ' A' ' 73' ' ' LEU . 74.6 m-85 -99.11 9.24 43.88 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -175.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.18 -44.86 96.63 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.246 0.341 . . . . 0.0 110.921 -176.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 49.6 p -137.28 159.6 41.45 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.923 0.889 . . . . 0.0 110.225 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.96 -34.17 72.91 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 123.871 0.732 . . . . 0.0 111.127 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.27 -40.39 98.53 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 124.518 1.136 . . . . 0.0 112.194 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.414 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 38.9 m -60.84 -50.74 72.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.32 0.648 . . . . 0.0 110.845 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.593 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -58.0 -45.24 87.14 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 123.257 0.348 . . . . 0.0 110.492 176.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.608 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.49 -44.1 80.32 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 124.667 1.229 . . . . 0.0 110.392 -179.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.2 -52.0 64.74 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.422 1.076 . . . . 0.0 110.277 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 31.6 m-85 -54.91 -58.97 5.46 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.118 0.886 . . . . 0.0 110.966 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 73' ' ' LEU . 29.5 m -66.4 -24.08 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.416 0.686 . . . . 0.0 112.791 -176.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 63.3 mm-40 -59.97 -52.13 66.73 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 169.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -65.5 -41.61 93.03 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.012 -172.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.469 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 27.7 mmmt -73.63 -43.93 58.29 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 123.762 0.663 . . . . 0.0 111.741 -172.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.87 -17.01 56.31 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 122.673 0.389 . . . . 0.0 111.548 -177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 62.2 m -88.63 -44.56 10.53 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.975 0.417 . . . . 0.0 111.285 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 69.1 m80 . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.232 -171.75 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.544 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -98.53 -36.43 9.92 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.39 1.076 . . . . 0.0 110.739 176.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -75.74 -12.25 60.15 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.05 0.94 . . . . 0.0 112.941 -168.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -54.91 -30.93 59.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.844 0.715 . . . . 0.0 111.872 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.44 -44.76 70.63 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.885 0.874 . . . . 0.0 110.709 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.421 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.09 -32.06 69.94 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 177.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.69 -47.58 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 122.963 0.505 . . . . 0.0 109.93 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.541 ' HA ' HD12 ' A' ' 11' ' ' LEU . 31.4 ptt180 -68.08 -29.94 69.01 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.383 0.427 . . . . 0.0 109.999 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.569 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.4 t30 -60.89 -46.31 91.15 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.473 0.709 . . . . 0.0 110.025 174.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.475 HG21 HD22 ' A' ' 49' ' ' LEU . 86.1 mt -60.83 -44.8 98.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.418 176.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' A' ' 8' ' ' ARG . 39.9 mt -62.14 -38.17 87.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.061 0.544 . . . . 0.0 111.066 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.587 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -73.34 -25.91 71.68 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.145 -0.48 . . . . 0.0 113.481 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.35 -51.3 17.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.649 0.78 . . . . 0.0 110.554 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.7 t -77.18 -55.32 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.669 -173.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.483 HD11 HD13 ' A' ' 37' ' ' LEU . 33.7 mt -84.02 -4.12 58.51 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.966 -171.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 68.16 44.46 1.41 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 124.694 1.197 . . . . 0.0 111.474 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 9.9 mp -73.61 -36.31 65.47 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.298 174.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 65.6 -87.1 0.09 OUTLIER Glycine 0 C--N 1.354 1.549 0 O-C-N 123.829 0.706 . . . . 0.0 112.659 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.23 -28.14 19.05 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.52 0.728 . . . . 0.0 111.123 177.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.486 HH11 HD23 ' A' ' 24' ' ' LEU . 2.0 tmt_? -67.31 -22.92 65.61 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.937 0.895 . . . . 0.0 110.411 -173.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.3 pttt -67.25 -29.29 68.88 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.028 0.531 . . . . 0.0 111.139 176.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -95.09 -18.96 20.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.452 0.701 . . . . 0.0 110.658 -173.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.405 HG22 ' O ' ' A' ' 20' ' ' ARG . 5.9 t -81.43 -10.98 59.4 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.732 0.413 . . . . 0.0 111.121 176.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.486 HD23 HH11 ' A' ' 20' ' ' ARG . 4.1 pp -102.66 152.8 20.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.813 0.445 . . . . 0.0 110.571 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.7 p -122.97 -171.63 2.33 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.485 1.114 . . . . 0.0 110.095 -174.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.73 67.57 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.308 0.643 . . . . 0.0 112.357 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.1 m -74.86 -26.71 59.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.614 0.766 . . . . 0.0 112.171 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 86.5 p -63.28 131.48 48.49 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 122.938 0.495 . . . . 0.0 111.34 -172.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.03 149.17 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.508 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.2 mt -111.17 -67.9 0.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.6 mt -57.92 112.13 1.39 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.601 0.36 . . . . 0.0 110.328 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 99.1 -28.93 13.01 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 115.426 -0.806 . . . . 0.0 113.569 177.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -88.62 -47.48 8.25 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 117.254 0.527 . . . . 0.0 110.63 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 30' ' ' LEU . 27.9 mm -76.25 115.74 49.78 Favored Pre-proline 0 N--CA 1.472 0.64 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 177.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.91 -5.14 16.43 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 122.381 2.054 . . . . 0.0 112.856 -174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -107.13 -0.24 22.95 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.461 0.704 . . . . 0.0 110.911 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.483 HD13 HD11 ' A' ' 15' ' ' LEU . 39.1 tp -94.74 80.29 3.76 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.466 0.65 . . . . 0.0 109.529 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 42' ' ' VAL . 3.8 p30 -95.97 -165.88 1.35 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.273 1.029 . . . . 0.0 110.275 176.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.623 ' O ' HG22 ' A' ' 42' ' ' VAL . 35.5 t -52.98 -69.58 0.11 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 125.391 1.476 . . . . 0.0 113.05 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 15.5 mmt -66.0 -23.84 66.65 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.793 -0.567 . . . . 0.0 111.388 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.63 83.6 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 175.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 39' ' ' SER . 15.1 m -66.99 -35.75 75.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.549 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.483 HG21 H312 ' A' ' 84' ' ' PNS . 7.2 t -65.0 -41.42 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 121.503 0.668 . . . . 0.0 110.701 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -61.93 -46.96 87.04 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 114.445 -1.252 . . . . 0.0 112.089 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.1 m -70.16 -28.99 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 CA-C-O 119.194 -0.431 . . . . 0.0 111.669 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.461 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 84.2 mt -59.0 -55.51 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.412 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 52.3 m -57.62 -42.46 83.34 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.918 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -38.77 90.89 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.941 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.475 HD22 HG21 ' A' ' 10' ' ' ILE . 2.4 mm? -56.98 -48.51 78.24 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.8 mm-40 -52.09 -50.91 60.69 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.491 1.119 . . . . 0.0 110.656 177.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 47' ' ' THR . 61.8 mm-40 -63.66 -58.12 7.91 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.642 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -69.47 -35.54 75.7 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -170.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -89.89 -13.6 36.02 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.13 49.18 2.74 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.088 0.955 . . . . 0.0 111.357 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -143.49 -169.48 3.07 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.087 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.0 t -138.01 131.26 30.45 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.959 0.503 . . . . 0.0 110.664 172.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.0 t -90.89 129.97 40.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 168.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.453 ' O ' HG13 ' A' ' 62' ' ' ILE . 36.2 t70 -74.79 148.39 40.39 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -65.84 -28.41 68.96 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.606 0.363 . . . . 0.0 111.789 -174.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.08 -29.25 66.2 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.71 0.804 . . . . 0.0 111.109 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -94.14 -13.48 26.69 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 122.623 0.369 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 58' ' ' ASP . 61.7 mt -75.7 107.82 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 172.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.5 t -115.7 167.31 11.03 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.933 0.893 . . . . 0.0 109.636 173.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.44 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -65.24 -31.83 73.18 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 165.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -71.26 -10.98 60.65 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.449 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.453 HG22 HD13 ' A' ' 73' ' ' LEU . 41.1 m -79.21 -41.38 28.44 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.585 ' HA ' HD21 ' A' ' 73' ' ' LEU . 43.2 m-85 -99.0 11.95 37.44 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.711 0.804 . . . . 0.0 113.048 -174.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.557 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.4 pt-20 -61.22 -44.62 96.98 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.294 0.638 . . . . 0.0 111.749 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.557 HG22 ' HG3' ' A' ' 68' ' ' GLU . 8.0 t -148.0 158.68 44.18 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 110.229 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.37 -35.89 70.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.572 0.749 . . . . 0.0 111.434 -178.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.87 -42.07 96.47 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.492 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -63.95 -47.31 80.96 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.295 0.638 . . . . 0.0 111.44 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.585 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -57.53 -45.03 85.5 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.49 -44.79 89.54 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.835 1.334 . . . . 0.0 110.899 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -58.73 -51.12 71.33 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 123.972 0.795 . . . . 0.0 110.645 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 22.7 m-85 -56.08 -55.34 34.17 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.74 -24.97 31.6 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 123.055 0.542 . . . . 0.0 111.774 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.3 mm-40 -56.49 -56.88 15.71 Favored 'General case' 0 C--N 1.365 1.248 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -59.85 -46.35 89.55 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.196 0.935 . . . . 0.0 111.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.7 mmmt -57.97 -55.81 30.1 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.365 1.066 . . . . 0.0 112.034 -176.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.29 -13.71 59.73 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.876 -175.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.1 m -78.47 -20.52 50.73 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 117.953 0.342 . . . . 0.0 111.445 173.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.313 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.545 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.457 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 1.9 tpt . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -54.99 -36.74 65.73 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -163.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' ' 7' ' ' VAL . 11.0 m-70 -73.5 -9.31 58.56 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.412 -173.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.7 -32.62 59.75 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.133 0.573 . . . . 0.0 110.166 173.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.56 -52.03 43.54 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.466 -176.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.32 -35.01 75.51 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.14 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 3' ' ' HIS . 97.5 t -66.18 -47.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 122.585 0.354 . . . . 0.0 110.361 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.479 ' HA ' HD12 ' A' ' 11' ' ' LEU . 36.2 ptt180 -69.88 -27.18 64.6 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.646 0.378 . . . . 0.0 110.431 -178.082 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -61.63 -45.66 93.12 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.222 173.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 6' ' ' ALA . 92.8 mt -64.09 -46.33 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.58 1.152 . . . . 0.0 111.508 177.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 8' ' ' ARG . 52.1 mt -61.58 -43.03 99.61 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.321 0.648 . . . . 0.0 110.966 -177.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.11 -19.14 77.66 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.056 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -75.09 -42.18 57.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 110.232 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 79.9 t -83.14 -46.23 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.26 -172.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -99.02 1.07 45.06 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.896 0.478 . . . . 0.0 111.991 -177.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.7 t30 60.05 63.19 1.48 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.86 1.264 . . . . 0.0 111.367 173.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.476 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 10.0 mp -81.49 -29.67 33.58 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.764 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 72.77 -105.94 1.85 Allowed Glycine 0 C--N 1.348 1.215 0 O-C-N 123.555 0.535 . . . . 0.0 112.35 176.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.6 -24.23 36.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.261 0.624 . . . . 0.0 110.443 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.567 HH11 HD23 ' A' ' 24' ' ' LEU . 2.3 tmt_? -64.78 -35.4 80.98 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.654 0.781 . . . . 0.0 109.66 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 52.6 pttt -67.08 -23.34 65.84 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.525 0.515 . . . . 0.0 111.549 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -94.59 -42.72 8.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 122.634 0.374 . . . . 0.0 110.724 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 20' ' ' ARG . 14.5 t -75.51 3.96 8.38 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.489 0.716 . . . . 0.0 112.43 -172.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.567 HD23 HH11 ' A' ' 20' ' ' ARG . 3.1 pp -95.97 -179.79 4.81 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.758 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 45.3 p -133.12 -171.94 2.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.564 1.146 . . . . 0.0 109.124 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.1 66.3 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.45 0.7 . . . . 0.0 111.728 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.5 m -75.61 -5.42 45.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.984 0.914 . . . . 0.0 111.997 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 29.2 t -71.0 130.47 41.66 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.928 0.491 . . . . 0.0 110.674 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.0 t -87.13 138.43 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.473 ' HA ' HG12 ' A' ' 34' ' ' ILE . 59.6 mt -105.62 -71.58 0.74 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.892 0.477 . . . . 0.0 111.304 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 71.1 mt -53.96 118.98 4.43 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 123.705 0.628 . . . . 0.0 111.02 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.43 -41.65 3.1 Favored Glycine 0 C--N 1.342 0.869 0 O-C-N 123.967 0.792 . . . . 0.0 113.401 177.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -72.14 -48.63 42.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.655 0.782 . . . . 0.0 111.19 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.473 HG12 ' HA ' ' A' ' 30' ' ' LEU . 35.3 mm -73.69 116.99 57.21 Favored Pre-proline 0 CA--C 1.545 0.758 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -74.15 -0.24 9.33 Favored 'Trans proline' 0 C--N 1.369 1.653 0 C-N-CA 122.8 2.333 . . . . 0.0 113.224 -175.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.417 ' H ' HG22 ' A' ' 34' ' ' ILE . 13.6 mm-40 -107.93 -2.4 19.81 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.915 0.886 . . . . 0.0 110.525 178.407 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 tt -106.19 102.59 11.99 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -175.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -112.48 -164.53 0.92 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.487 1.115 . . . . 0.0 110.583 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.545 ' O ' HG22 ' A' ' 42' ' ' VAL . 45.0 t -45.38 -67.67 0.26 Allowed 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 126.668 1.987 . . . . 0.0 113.231 171.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 22.3 mmt -62.48 -25.97 68.28 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.032 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 45' ' ' VAL . . . -64.99 -38.69 91.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 118.874 -0.584 . . . . 0.0 112.276 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.545 HG22 ' O ' ' A' ' 39' ' ' SER . 2.5 m -61.11 -38.45 79.66 Favored 'Isoleucine or valine' 0 C--N 1.368 1.406 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 176.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.557 HG21 H312 ' A' ' 84' ' ' PNS . 10.6 t -69.58 -45.43 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.771 -177.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -57.59 -42.72 83.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.124 -1.398 . . . . 0.0 112.077 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 41' ' ' ALA . 21.2 m -78.91 -28.03 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.492 -0.766 . . . . 0.0 112.175 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.6 mt -59.83 -55.59 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 171.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.426 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 30.1 m -54.52 -48.7 71.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.921 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.07 99.12 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.057 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -54.87 -51.66 65.25 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.283 0.633 . . . . 0.0 109.831 175.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.8 mm-40 -54.01 -44.2 70.7 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.471 1.108 . . . . 0.0 111.181 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 47' ' ' THR . 13.1 mm-40 -63.25 -64.15 0.99 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.71 -179.125 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -61.98 -41.43 98.01 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.703 0.801 . . . . 0.0 113.049 -170.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.419 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 65.2 m-85 -88.0 -21.32 24.89 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 118.962 -0.542 . . . . 0.0 112.016 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 63.88 58.95 1.17 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.18 0.992 . . . . 0.0 111.113 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -147.38 -177.19 5.56 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.003 -0.998 . . . . 0.0 109.749 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.2 t -131.1 117.9 19.77 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.531 0.333 . . . . 0.0 111.014 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.6 t -76.8 124.89 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 168.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 34.1 t70 -65.6 135.92 55.68 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.597 0.359 . . . . 0.0 110.315 -176.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -60.83 -27.58 68.18 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.243 0.617 . . . . 0.0 112.037 -173.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -82.07 -19.0 41.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.302 0.641 . . . . 0.0 112.272 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -92.29 -19.67 21.91 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 176.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 58' ' ' ASP . 57.7 mt -72.84 113.51 10.58 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.2 t -129.5 175.62 8.64 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 125.066 1.346 . . . . 0.0 108.389 175.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.45 -30.24 70.55 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 168.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -72.57 -13.6 61.43 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.603 0.761 . . . . 0.0 111.758 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 49.5 m -78.31 -32.42 49.27 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.054 0.542 . . . . 0.0 109.625 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.491 ' HA ' HD21 ' A' ' 73' ' ' LEU . 59.1 m-85 -108.94 7.16 25.83 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.633 0.773 . . . . 0.0 112.998 -177.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.96 -40.53 95.14 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 117.655 0.207 . . . . 0.0 111.043 -176.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.7 p -135.65 163.86 29.18 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.727 0.811 . . . . 0.0 110.241 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.48 -35.83 78.76 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.582 173.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.42 -30.99 75.79 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.026 0.829 . . . . 0.0 112.68 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.4 m -67.92 -51.73 44.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.353 0.661 . . . . 0.0 110.458 176.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.92 -46.99 86.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 122.915 0.134 . . . . 0.0 110.864 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -52.74 -50.39 63.55 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.596 1.185 . . . . 0.0 109.742 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.32 -56.48 18.09 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.582 1.153 . . . . 0.0 110.426 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.461 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.4 m-85 -57.21 -54.76 43.08 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.95 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 17.2 m -67.79 -25.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.048 0.539 . . . . 0.0 111.616 -176.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 69.1 mm-40 -60.56 -46.65 89.42 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 171.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -59.03 -50.74 72.94 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 123.518 0.511 . . . . 0.0 110.665 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -63.48 -50.99 67.5 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.715 -170.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.12 -13.93 60.9 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.155 0.582 . . . . 0.0 112.157 -177.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.3 m -89.63 -1.37 58.0 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.69 0.396 . . . . 0.0 111.553 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.3 m80 . . . . . 0 N--CA 1.48 1.027 0 C-N-CA 123.831 0.852 . . . . 0.0 109.145 175.367 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.557 H312 HG21 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.22 0.533 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.24 -34.48 10.32 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.096 0.959 . . . . 0.0 110.394 170.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.406 ' O ' HG23 ' A' ' 7' ' ' VAL . 32.2 m170 -75.06 -20.05 59.72 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -53.71 -28.95 36.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 123.57 0.543 . . . . 0.0 111.898 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -65.26 -48.38 73.41 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 123.514 0.726 . . . . 0.0 111.083 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.13 -30.81 62.48 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.169 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 3' ' ' HIS . 91.7 t -65.08 -46.6 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 39.6 ptt180 -74.56 -24.89 59.0 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.988 0.515 . . . . 0.0 110.641 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.431 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 48.7 t30 -61.45 -47.04 87.55 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 172.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.403 HG21 HD22 ' A' ' 49' ' ' LEU . 93.6 mt -62.35 -45.66 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.955 176.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.41 -42.9 98.76 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.797 0.439 . . . . 0.0 110.961 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -70.58 -18.93 76.01 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.206 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -81.85 -52.49 7.05 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.053 0.541 . . . . 0.0 111.161 174.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.9 t -68.05 -57.99 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.321 0.648 . . . . 0.0 109.84 -175.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.471 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.0 mm? -81.21 -10.93 59.53 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 123.649 0.593 . . . . 0.0 111.272 -176.021 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 66.65 47.94 1.51 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.454 1.102 . . . . 0.0 110.868 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 3.5 mm? -66.53 -34.38 77.79 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 171.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.95 -93.27 0.15 Allowed Glycine 0 C--N 1.355 1.588 0 O-C-N 123.938 0.774 . . . . 0.0 112.988 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -79.19 -34.52 42.95 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.353 1.061 . . . . 0.0 110.413 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HA ' HG22 ' A' ' 23' ' ' THR . 1.7 tmt_? -68.58 -25.34 64.84 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.577 -171.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 56.1 pttt -64.98 -29.06 69.96 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.476 0.179 . . . . 0.0 111.33 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -85.53 -29.9 23.84 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 122.864 0.465 . . . . 0.0 110.982 -175.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 20' ' ' ARG . 12.1 t -84.37 -9.86 58.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.045 0.538 . . . . 0.0 111.819 -176.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 pp -94.22 151.79 19.19 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 177.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.0 p -112.67 -173.54 2.27 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.809 0.844 . . . . 0.0 109.938 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 -23.62 66.11 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.042 0.537 . . . . 0.0 111.332 172.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.3 m -81.16 0.98 33.93 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.26 1.024 . . . . 0.0 112.734 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.7 t -81.94 137.7 35.12 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.653 0.381 . . . . 0.0 110.651 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -86.91 145.76 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 124.331 1.052 . . . . 0.0 109.188 175.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.4 mt -108.18 -70.68 0.79 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.233 0.613 . . . . 0.0 110.676 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.483 HD23 HD12 ' A' ' 37' ' ' LEU . 21.4 mt -51.3 113.99 1.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.243 1.017 . . . . 0.0 112.269 178.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.49 -27.93 4.03 Favored Glycine 0 C--N 1.348 1.202 0 O-C-N 123.942 0.777 . . . . 0.0 114.059 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -76.7 -59.74 2.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.319 0.648 . . . . 0.0 109.915 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.439 HG22 ' H ' ' A' ' 36' ' ' GLU . 43.9 mm -70.84 121.98 85.49 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 173.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -69.37 -9.22 25.67 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 122.653 2.235 . . . . 0.0 112.452 -175.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 16.6 mm-40 -94.48 -21.87 18.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.831 0.853 . . . . 0.0 110.528 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.483 HD12 HD23 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -82.45 80.77 8.52 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -174.191 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 11.3 t70 -112.55 -168.45 1.32 Allowed 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 125.204 1.402 . . . . 0.0 109.516 -177.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.2 t -51.06 -70.42 0.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 125.751 1.621 . . . . 0.0 114.486 -173.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.8 mmm -65.0 -22.06 66.94 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.632 -0.667 . . . . 0.0 111.251 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.471 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -67.07 -35.96 80.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.481 0.713 . . . . 0.0 111.932 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -64.54 -37.9 81.24 Favored 'Isoleucine or valine' 0 C--N 1.372 1.545 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.504 HG21 H312 ' A' ' 84' ' ' PNS . 19.1 t -67.66 -44.33 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.684 -179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -61.7 -38.85 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.132 -1.394 . . . . 0.0 112.532 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.416 ' O ' HD23 ' A' ' 49' ' ' LEU . 30.1 m -80.1 -29.15 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.097 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.559 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -59.8 -57.06 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 171.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.9 m -55.72 -44.39 77.43 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.624 1.202 . . . . 0.0 111.37 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.49 -47.79 84.13 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.003 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -52.17 -49.75 63.18 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.424 0.69 . . . . 0.0 110.174 174.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.9 mm-40 -57.47 -43.25 83.89 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.994 0.918 . . . . 0.0 111.368 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -67.08 -52.45 41.93 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.785 0.834 . . . . 0.0 112.59 -176.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -69.57 -39.35 77.42 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.404 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 72.7 m-85 -91.03 -16.8 27.32 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 57.97 64.27 1.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 124.611 1.164 . . . . 0.0 111.11 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.404 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -149.24 -176.36 5.34 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.679 0.792 . . . . 0.0 109.622 178.156 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -134.89 116.73 15.08 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 122.357 0.263 . . . . 0.0 111.421 171.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.556 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.8 t -69.34 127.85 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 168.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.466 ' O ' HG13 ' A' ' 62' ' ' ILE . 32.0 t70 -72.41 142.86 48.68 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 118.142 0.428 . . . . 0.0 110.767 -173.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -50.3 -44.65 54.1 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.521 1.128 . . . . 0.0 112.592 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.7 -21.76 64.39 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.107 -174.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -97.98 -20.97 17.09 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.157 0.183 . . . . 0.0 110.909 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 58' ' ' ASP . 60.9 mt -75.47 117.48 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 0.0 110.264 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 t -144.37 179.59 7.15 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 124.117 0.967 . . . . 0.0 109.491 174.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.414 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -60.22 -34.7 74.02 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.71 0.804 . . . . 0.0 110.151 167.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -67.84 -17.15 64.41 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -81.11 -37.82 28.27 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.453 0.701 . . . . 0.0 110.024 174.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.504 ' HA ' HD21 ' A' ' 73' ' ' LEU . 39.2 m-85 -104.85 14.7 29.11 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.28 0.632 . . . . 0.0 112.402 -176.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.54 -46.14 89.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.65 0.38 . . . . 0.0 110.605 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.3 p -137.28 158.41 44.49 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.638 0.775 . . . . 0.0 110.43 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.3 tp -55.41 -39.72 70.56 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.504 0.722 . . . . 0.0 110.71 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.46 95.76 Favored Glycine 0 C--N 1.347 1.176 0 O-C-N 124.452 1.095 . . . . 0.0 112.474 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -60.09 -45.31 93.38 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 122.787 0.435 . . . . 0.0 110.978 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.86 -42.18 99.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 122.999 0.187 . . . . 0.0 110.759 175.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.564 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.16 -49.03 79.42 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 124.153 0.908 . . . . 0.0 111.03 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.84 -43.74 92.07 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.634 0.774 . . . . 0.0 110.696 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.517 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 7.1 m-85 -58.08 -52.0 67.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 119.235 -0.412 . . . . 0.0 110.587 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.3 m -70.88 -24.73 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.003 0.521 . . . . 0.0 111.975 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 78.6 mm-40 -56.71 -44.85 81.99 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 168.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -73.19 -39.42 65.6 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.307 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.556 ' HE2' ' HA ' ' A' ' 57' ' ' VAL . 32.5 mmmt -64.91 -53.0 53.39 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.481 0.712 . . . . 0.0 111.912 -173.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.07 -13.1 60.45 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.436 -177.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.8 m -109.66 20.98 17.51 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.78 0.832 . . . . 0.0 111.845 172.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -172.662 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.504 H312 HG21 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.618 0.247 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -98.02 -37.82 9.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.009 0.923 . . . . 0.0 110.323 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.4 m80 -75.14 -12.98 60.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.992 0.917 . . . . 0.0 113.102 -169.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -57.67 -22.13 44.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 123.541 0.526 . . . . 0.0 111.689 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.3 -58.98 6.18 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.265 1.026 . . . . 0.0 110.926 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.66 58.82 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.783 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 87.4 t -63.53 -54.84 27.41 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -69.28 -28.04 65.95 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.289 0.236 . . . . 0.0 110.516 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -60.1 -52.57 64.77 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.319 0.647 . . . . 0.0 109.906 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.434 HG21 HD22 ' A' ' 49' ' ' LEU . 92.6 mt -64.05 -51.9 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.997 -178.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.413 HD13 HD13 ' A' ' 30' ' ' LEU . 76.7 mt -61.05 -39.63 90.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.074 0.55 . . . . 0.0 111.59 -175.036 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.571 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.1 -23.94 70.24 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 121.329 -0.462 . . . . 0.0 113.366 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.34 -27.01 38.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.033 0.533 . . . . 0.0 110.915 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.2 t -86.28 -59.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.336 0.655 . . . . 0.0 109.644 177.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.462 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -77.38 3.77 12.42 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -174.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 71.5 38.01 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.293 1.037 . . . . 0.0 111.192 167.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.412 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.6 mp -75.78 -32.08 59.77 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.165 172.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.5 -95.9 0.27 Allowed Glycine 0 C--N 1.353 1.51 0 O-C-N 123.556 0.535 . . . . 0.0 113.224 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -90.11 -25.29 20.8 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.025 0.93 . . . . 0.0 110.897 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.11 -26.82 69.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.574 0.749 . . . . 0.0 111.348 -175.523 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.8 pttt -66.26 -30.32 70.73 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.041 0.537 . . . . 0.0 111.731 178.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -81.91 -22.3 36.87 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.513 0.725 . . . . 0.0 111.081 -175.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 t -93.49 2.62 56.38 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.836 0.454 . . . . 0.0 112.054 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.439 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -108.06 159.06 16.87 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.951 -0.468 . . . . 0.0 110.743 176.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -116.26 -174.92 2.64 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.663 0.785 . . . . 0.0 110.915 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -67.3 -17.69 64.88 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.28 0.632 . . . . 0.0 111.933 175.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -74.23 -24.03 59.25 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.34 0.656 . . . . 0.0 111.46 173.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.1 t -63.54 125.43 24.22 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.712 0.805 . . . . 0.0 111.455 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.8 t -79.23 147.14 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.413 HD13 HD13 ' A' ' 11' ' ' LEU . 67.5 mt -116.43 -68.14 0.94 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.241 0.616 . . . . 0.0 110.07 -177.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 tt -61.86 111.23 1.8 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.54 -26.95 22.67 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.461 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -88.92 -49.89 6.52 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 117.321 0.56 . . . . 0.0 110.671 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.4 mm -81.35 118.48 72.46 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.93 -6.68 18.4 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.686 2.257 . . . . 0.0 112.848 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -94.24 -18.14 21.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.88 0.872 . . . . 0.0 111.06 -175.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.5 tp -86.66 88.52 7.68 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 122.917 0.487 . . . . 0.0 109.719 -174.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.518 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 13.0 t70 -120.76 -170.68 2.04 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.045 0.938 . . . . 0.0 109.66 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.6 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.1 t -40.27 -69.4 0.13 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 127.615 2.366 . . . . 0.0 114.883 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -66.89 -29.76 69.74 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.211 -0.931 . . . . 0.0 111.761 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.518 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -66.79 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 39' ' ' SER . 28.6 m -70.42 -33.32 53.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.2 -46.79 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.509 0.671 . . . . 0.0 110.033 175.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -56.68 -48.71 77.04 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.27 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.409 HG22 ' HA ' ' A' ' 42' ' ' VAL . 27.6 m -72.45 -32.9 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.915 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.536 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -60.01 -52.26 63.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.3 m -55.06 -44.61 74.93 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 124.579 1.175 . . . . 0.0 111.177 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -42.35 99.66 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.763 0.825 . . . . 0.0 111.883 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.434 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -57.82 -46.29 84.92 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.071 0.548 . . . . 0.0 110.232 173.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.8 mm-40 -54.46 -44.18 72.33 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.232 1.013 . . . . 0.0 110.827 178.213 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' THR . 43.4 mm-40 -63.01 -57.18 11.56 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.724 -176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -66.35 -44.91 81.93 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.604 0.565 . . . . 0.0 112.258 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -88.56 -9.46 52.21 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 118.941 -0.552 . . . . 0.0 112.359 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 59.47 45.28 13.78 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.271 1.028 . . . . 0.0 111.656 175.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -139.02 -177.02 4.7 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.425 -174.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.7 t -134.49 113.66 12.05 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.2 t -69.06 131.91 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 16.9 t70 -67.37 134.04 50.73 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.46 0.704 . . . . 0.0 110.158 -176.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -57.98 -38.42 76.05 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.886 0.875 . . . . 0.0 112.949 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -72.35 -20.18 61.51 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.938 0.495 . . . . 0.0 111.995 -176.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 18.3 pt-20 -98.71 -8.92 25.34 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.382 0.273 . . . . 0.0 110.641 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 51.5 mt -87.09 117.81 31.94 Favored 'Isoleucine or valine' 0 C--N 1.359 0.979 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.8 t -155.91 -172.3 4.07 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.308 1.043 . . . . 0.0 108.459 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.85 77.75 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.719 0.408 . . . . 0.0 110.655 176.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.1 mm-40 -68.55 -12.26 61.04 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.149 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.48 HG22 HD13 ' A' ' 73' ' ' LEU . 23.2 m -81.29 -45.14 16.66 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.215 0.606 . . . . 0.0 109.606 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.542 ' HA ' HD21 ' A' ' 73' ' ' LEU . 70.0 m-85 -97.75 6.25 48.14 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -174.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.497 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -57.03 -45.13 83.33 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.724 0.64 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.497 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -146.63 160.21 42.46 Favored 'General case' 0 C--O 1.249 1.058 0 C-N-CA 123.466 0.707 . . . . 0.0 110.036 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 17.3 tp -58.84 -35.66 73.27 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.774 0.83 . . . . 0.0 110.852 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.82 -42.14 96.4 Favored Glycine 0 C--N 1.349 1.276 0 O-C-N 124.635 1.209 . . . . 0.0 112.107 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.5 m -62.58 -49.45 75.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.974 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -57.69 -46.22 84.61 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.137 0.426 . . . . 0.0 110.196 178.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.561 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.46 -39.37 90.65 Favored 'General case' 0 C--O 1.217 -0.65 0 O-C-N 124.529 1.143 . . . . 0.0 111.305 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.78 -49.68 67.47 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.733 0.813 . . . . 0.0 110.621 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 42.4 m-85 -55.72 -49.67 72.42 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.55 0.531 . . . . 0.0 110.32 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.2 m -70.73 -25.66 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -55.69 -48.81 74.48 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -66.9 -41.27 87.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.146 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -63.2 -54.1 42.84 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.65 0.78 . . . . 0.0 112.238 -173.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.44 -13.5 61.08 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.328 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.1 m -97.41 -22.23 16.72 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.422 0.689 . . . . 0.0 111.45 174.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 . . . . . 0 CA--C 1.548 0.901 0 C-N-CA 123.963 0.905 . . . . 0.0 109.385 -174.502 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.613 ' SD ' ' HG3' ' A' ' 78' ' ' GLU . 7.1 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 9.9 pm0 -98.23 -39.32 8.91 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 0.0 111.724 -175.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' HG23 ' A' ' 7' ' ' VAL . 28.6 m170 -76.8 -10.97 59.75 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.24 -170.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -55.35 -31.88 62.08 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 118.664 0.666 . . . . 0.0 111.799 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.72 -41.54 59.98 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.447 0.699 . . . . 0.0 111.435 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.438 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.27 -37.22 83.09 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.959 176.181 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -67.1 -47.3 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.052 178.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.41 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 28.7 ptt180 -68.65 -25.93 65.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.563 0.345 . . . . 0.0 110.476 -179.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 23.8 t30 -61.86 -50.49 72.02 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.67 0.788 . . . . 0.0 109.531 173.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.558 HG21 HD22 ' A' ' 49' ' ' LEU . 91.5 mt -59.83 -42.72 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.651 1.18 . . . . 0.0 111.281 178.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 46.0 mt -68.96 -41.75 77.54 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.136 0.574 . . . . 0.0 111.056 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.461 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -71.91 -18.27 77.51 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 116.147 -0.478 . . . . 0.0 113.148 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -79.95 -53.75 6.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.848 0.859 . . . . 0.0 110.006 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.495 HG13 ' ND2' ' A' ' 44' ' ' ASN . 79.5 t -73.32 -49.54 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.09 0.956 . . . . 0.0 111.387 -173.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.413 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 0.9 OUTLIER -83.93 -3.09 57.69 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.269 0.228 . . . . 0.0 110.84 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 61.64 53.45 3.26 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 124.962 1.305 . . . . 0.0 111.214 172.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.446 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.8 mp -75.81 -28.16 58.22 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.8 171.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.46 -89.03 0.08 OUTLIER Glycine 0 C--N 1.353 1.491 0 O-C-N 124.211 0.944 . . . . 0.0 112.408 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -93.24 -29.34 15.74 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.827 0.851 . . . . 0.0 111.448 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.68 -26.35 66.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.99 0.516 . . . . 0.0 111.355 -170.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 58.1 pttt -58.57 -28.11 65.23 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.701 0.4 . . . . 0.0 111.569 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -79.08 -25.73 43.06 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.81 0.844 . . . . 0.0 110.957 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.1 t -93.81 1.46 56.44 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.614 0.366 . . . . 0.0 111.926 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -109.72 151.46 26.89 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.895 -0.503 . . . . 0.0 110.038 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.8 p -123.51 -171.73 2.37 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.688 0.795 . . . . 0.0 109.996 -175.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.7 -20.3 65.94 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.442 0.697 . . . . 0.0 112.478 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 m -75.89 -21.74 56.83 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.193 0.597 . . . . 0.0 111.859 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -71.55 137.62 48.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.669 0.787 . . . . 0.0 111.422 -175.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.88 160.72 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 C-N-CA 124.573 1.149 . . . . 0.0 109.224 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.6 mt -117.1 -68.51 0.91 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.03 109.31 1.24 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.805 174.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.25 -34.27 5.81 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.273 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -77.27 -57.65 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.425 HG22 ' H ' ' A' ' 36' ' ' GLU . 12.9 mm -81.73 116.46 63.3 Favored Pre-proline 0 CA--C 1.543 0.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -175.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -77.18 -8.08 17.4 Favored 'Trans proline' 0 C--N 1.369 1.633 0 C-N-CA 122.459 2.106 . . . . 0.0 112.02 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.425 ' H ' HG22 ' A' ' 34' ' ' ILE . 6.0 mm-40 -96.48 -6.82 36.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.983 0.913 . . . . 0.0 110.659 -178.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.1 tp -81.72 80.76 7.97 Favored 'General case' 0 C--N 1.349 0.584 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.431 ' N ' ' HB3' ' A' ' 41' ' ' ALA . 22.3 t70 -82.01 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.476 1.511 . . . . 0.0 110.607 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' VAL . 48.1 t -43.95 -66.73 0.35 Allowed 'General case' 0 CA--C 1.566 1.577 0 C-N-CA 126.163 1.785 . . . . 0.0 112.469 170.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 95.0 mmm -70.56 -15.26 62.75 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.652 -0.655 . . . . 0.0 111.748 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.431 ' HB3' ' N ' ' A' ' 38' ' ' ASP . . . -77.22 -25.34 51.56 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.319 174.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' SER . 4.7 m -69.61 -37.99 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.12 -42.33 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.648 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.495 ' ND2' HG13 ' A' ' 14' ' ' VAL . 59.6 t30 -68.26 -37.75 81.07 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.553 -176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.2 m -72.53 -35.71 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.69 177.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.503 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 93.1 mt -59.97 -48.51 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 33.0 m -56.86 -45.06 82.72 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 124.373 1.046 . . . . 0.0 110.732 177.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.26 -41.65 98.63 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.689 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.558 HD22 HG21 ' A' ' 10' ' ' ILE . 3.4 mm? -56.58 -46.68 80.67 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.197 0.599 . . . . 0.0 109.9 176.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.2 mm-40 -51.66 -50.52 60.2 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.266 1.026 . . . . 0.0 110.386 176.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.2 mm-40 -59.81 -63.96 1.11 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.76 -176.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -65.05 -46.02 82.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.651 -169.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -87.67 -7.66 57.13 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.1 t70 65.19 36.41 7.17 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.93 0.892 . . . . 0.0 111.042 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.19 -175.53 3.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.413 0.685 . . . . 0.0 110.118 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -123.14 135.64 54.44 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 37.2 t -84.75 125.19 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 170.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' HG13 ' A' ' 62' ' ' ILE . 30.2 t70 -75.13 151.33 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.148 0.579 . . . . 0.0 111.083 -174.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -53.45 -41.76 66.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.406 1.082 . . . . 0.0 113.137 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -67.58 -17.96 64.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.836 0.854 . . . . 0.0 111.962 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -115.44 8.01 15.16 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.524 0.729 . . . . 0.0 111.436 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 58' ' ' ASP . 28.9 mt -98.41 105.44 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 77.5 p -146.27 173.23 12.43 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.645 0.778 . . . . 0.0 109.532 171.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.76 71.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 169.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.33 -21.1 66.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.147 0.579 . . . . 0.0 111.469 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.2 m -72.52 -40.31 66.89 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.259 0.624 . . . . 0.0 110.071 175.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.717 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.3 m-85 -97.43 18.32 15.55 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.634 0.774 . . . . 0.0 113.037 -174.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.533 ' HG3' HG22 ' A' ' 69' ' ' THR . 9.5 pt-20 -63.58 -46.34 86.29 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.681 0.392 . . . . 0.0 111.629 178.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.533 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -145.51 155.05 42.85 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 123.354 0.662 . . . . 0.0 110.531 -177.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.56 -32.73 67.41 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.724 0.81 . . . . 0.0 111.296 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.15 -41.68 98.25 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.953 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.2 m -60.4 -52.92 63.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.915 0.486 . . . . 0.0 110.33 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.717 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -61.34 -39.73 91.64 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 123.568 0.542 . . . . 0.0 110.938 -178.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.567 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.08 -49.68 75.1 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.424 1.077 . . . . 0.0 109.988 178.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.14 -39.46 89.86 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.708 0.63 . . . . 0.0 111.702 -177.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.508 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 34.9 m-85 -59.79 -54.75 42.64 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.7 m -67.1 -26.16 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 122.829 0.451 . . . . 0.0 111.787 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.613 ' HG3' ' SD ' ' A' ' 1' ' ' MET . 76.4 mm-40 -57.23 -51.9 67.49 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 170.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 47.9 m170 -63.01 -49.38 74.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.134 -175.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.1 mmmt -60.54 -55.15 36.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.784 0.834 . . . . 0.0 112.04 -172.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.59 -14.32 61.59 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.871 -176.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.4 m -89.52 -28.36 19.68 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.963 0.505 . . . . 0.0 111.442 173.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.6 m170 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.921 -0.562 . . . . 0.0 109.838 177.883 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.444 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.581 ' HG2' ' HB1' ' A' ' 74' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -96.88 -44.28 7.11 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 118.446 0.566 . . . . 0.0 112.067 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.423 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 82.6 m-70 -75.11 -12.86 60.4 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.939 -169.579 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.29 -31.2 63.43 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 118.216 0.462 . . . . 0.0 111.4 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -66.53 -52.88 41.0 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 125.006 1.322 . . . . 0.0 110.628 -178.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.1 -32.25 71.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.506 -178.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 3' ' ' HIS . 86.5 t -68.43 -48.67 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.742 0.417 . . . . 0.0 110.354 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 40.7 ptt180 -67.55 -30.11 69.67 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.449 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 37.4 t30 -62.24 -46.64 87.92 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.531 0.733 . . . . 0.0 109.914 176.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 6' ' ' ALA . 69.8 mt -61.71 -56.38 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 O-C-N 124.366 1.041 . . . . 0.0 111.672 179.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.547 HD22 HD13 ' A' ' 30' ' ' LEU . 9.7 mp -64.83 -34.03 77.4 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.922 0.139 . . . . 0.0 111.351 -176.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.54 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.79 -18.22 79.1 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 119.813 -0.437 . . . . 0.0 113.309 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.28 -53.04 7.34 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.742 0.417 . . . . 0.0 110.289 174.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.73 -58.57 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.325 1.05 . . . . 0.0 109.829 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 37' ' ' LEU . 64.0 mt -77.15 -8.21 57.14 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.135 -175.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.57 62.94 1.05 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.475 1.11 . . . . 0.0 110.717 172.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 4.1 mm? -85.27 -27.96 25.64 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.587 170.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 69.1 -107.5 2.12 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.873 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.33 -26.22 51.88 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.632 0.773 . . . . 0.0 111.147 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.574 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.68 -32.93 74.09 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.879 0.872 . . . . 0.0 110.068 -172.172 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.54 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.5 pttt -64.37 -34.83 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.95 -177.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -89.49 -21.19 23.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.218 0.207 . . . . 0.0 110.499 -173.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.437 HG22 ' HA ' ' A' ' 20' ' ' ARG . 6.8 t -91.96 7.14 43.51 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.027 0.531 . . . . 0.0 110.94 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -109.0 156.15 20.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.893 0.477 . . . . 0.0 109.77 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 p -111.88 -178.26 3.39 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.248 1.019 . . . . 0.0 110.709 -175.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.504 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -66.53 -27.66 67.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.363 0.665 . . . . 0.0 111.315 177.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.4 p -78.32 -4.04 46.06 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.65 0.78 . . . . 0.0 112.419 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.9 t -80.6 141.01 35.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.137 0.575 . . . . 0.0 110.198 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.3 t -80.65 151.63 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.437 1.095 . . . . 0.0 109.026 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 11' ' ' LEU . 82.5 mt -118.58 -69.74 0.83 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.131 0.572 . . . . 0.0 109.929 177.478 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.8 122.46 18.17 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 175.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.48 -34.78 5.04 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.006 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -86.32 -67.49 0.81 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.195 0.598 . . . . 0.0 111.014 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.453 HG22 ' H ' ' A' ' 36' ' ' GLU . 37.2 mm -64.47 119.66 58.69 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 123.278 0.631 . . . . 0.0 109.981 -172.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -72.9 -6.38 18.91 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.719 2.279 . . . . 0.0 112.699 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.453 ' H ' HG22 ' A' ' 34' ' ' ILE . 22.4 mm-40 -96.48 -14.6 22.24 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.756 0.822 . . . . 0.0 110.872 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.524 HD23 HD11 ' A' ' 15' ' ' LEU . 3.1 tm? -84.93 85.29 7.49 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -178.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.493 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 8.3 t70 -108.79 -173.19 2.21 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.377 1.071 . . . . 0.0 108.846 177.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -49.37 -70.93 0.07 Allowed 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 125.711 1.604 . . . . 0.0 114.5 -173.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -62.75 -25.58 68.27 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 121.708 -0.62 . . . . 0.0 111.358 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.493 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -69.43 -29.53 67.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.312 0.645 . . . . 0.0 112.355 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -65.98 -40.5 87.53 Favored 'Isoleucine or valine' 0 C--N 1.37 1.478 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 172.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.525 HG21 H312 ' A' ' 84' ' ' PNS . 4.9 t -67.15 -40.43 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.463 -178.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -65.12 -43.12 92.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.272 . . . . 0.0 112.037 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.0 m -72.52 -33.13 44.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.089 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -60.92 -48.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 173.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.463 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 68.1 m -55.77 -44.04 77.29 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 124.301 1.001 . . . . 0.0 110.528 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.57 86.54 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.212 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.442 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -54.21 -50.63 66.66 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 172.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -54.89 -46.04 74.76 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.17 177.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 47' ' ' THR . 30.0 mm-40 -61.66 -60.58 3.46 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.061 0.944 . . . . 0.0 112.093 -177.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -66.91 -46.29 75.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -172.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.502 ' HB3' HD11 ' A' ' 81' ' ' LEU . 93.4 m-85 -84.1 -19.64 33.92 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-O 119.082 -0.485 . . . . 0.0 112.078 -177.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.56 47.74 1.59 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.248 1.019 . . . . 0.0 111.633 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.456 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.5 OUTLIER -137.6 -174.27 3.72 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.906 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.8 t -134.84 117.08 15.52 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 122.767 0.427 . . . . 0.0 110.962 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.424 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 11.7 t -68.96 132.79 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.048 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 33.5 t70 -76.26 147.08 38.53 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.592 0.357 . . . . 0.0 110.392 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -57.39 -42.34 81.98 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.199 0.599 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.08 -14.96 62.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.209 0.604 . . . . 0.0 112.289 -174.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.8 pt-20 -103.31 -11.34 17.99 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.864 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 54.5 mt -85.92 116.17 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.234 0.614 . . . . 0.0 110.392 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -145.85 -178.96 6.38 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.879 1.272 . . . . 0.0 108.849 171.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.473 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -65.18 -34.37 78.22 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 171.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -71.94 -11.17 60.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.671 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.6 m -76.29 -36.67 58.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.226 0.61 . . . . 0.0 110.058 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.596 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.9 m-85 -99.79 14.76 29.18 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.948 0.499 . . . . 0.0 112.082 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -60.89 -45.62 93.86 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.432 0.293 . . . . 0.0 110.659 -178.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.0 p -138.04 163.59 31.22 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.784 0.833 . . . . 0.0 110.168 176.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.504 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 55.0 tp -59.29 -37.18 77.06 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.029 176.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.1 -34.3 89.57 Favored Glycine 0 C--N 1.34 0.753 0 CA-C-N 114.684 -1.144 . . . . 0.0 112.346 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -60.31 -54.89 40.24 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 122.859 0.464 . . . . 0.0 109.885 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.96 -44.3 91.46 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 124.025 0.828 . . . . 0.0 110.313 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -54.5 -46.87 73.55 Favored 'General case' 0 C--O 1.217 -0.636 0 O-C-N 124.64 1.212 . . . . 0.0 110.969 -178.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.48 HD22 ' SD ' ' A' ' 1' ' ' MET . 3.6 mm? -65.87 -47.64 74.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.813 0.845 . . . . 0.0 111.346 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 52.6 m-85 -56.39 -53.03 62.14 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.7 m -70.68 -23.81 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.653 0.781 . . . . 0.0 112.205 -177.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -54.19 -52.88 59.8 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -70.64 -29.6 66.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.989 -1.46 . . . . 0.0 112.114 -173.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -72.04 -58.09 3.73 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.478 0.711 . . . . 0.0 110.847 178.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 53' ' ' PHE . 3.9 mm? -68.2 -11.24 58.95 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.556 -176.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.3 m -55.26 -40.6 71.16 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.131 0.572 . . . . 0.0 111.113 167.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 . . . . . 0 C--O 1.253 1.239 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.169 178.054 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PNS . . . . . 0.525 H312 HG21 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.949 0.404 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -94.1 -55.03 3.35 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.888 0.851 . . . . 0.0 109.343 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.403 ' O ' HG23 ' A' ' 7' ' ' VAL . 9.9 m-70 -78.21 -9.2 59.1 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.593 -163.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -53.2 -32.48 48.25 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.551 0.74 . . . . 0.0 111.887 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -66.12 -50.64 63.32 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 124.576 1.151 . . . . 0.0 111.074 -177.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.71 -29.58 63.5 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.503 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 3' ' ' HIS . 90.1 t -67.82 -48.28 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.845 0.458 . . . . 0.0 109.995 177.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -70.3 -28.26 65.04 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.542 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 44.0 t30 -63.13 -46.52 86.88 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.326 0.651 . . . . 0.0 109.831 173.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.57 -53.86 42.45 Favored 'Isoleucine or valine' 0 C--N 1.351 0.643 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.258 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.54 -34.8 79.09 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.195 0.31 . . . . 0.0 110.551 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.56 -20.53 71.96 Favored Glycine 0 C--N 1.343 0.963 0 CA-C-O 119.947 -0.363 . . . . 0.0 113.398 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -86.06 -56.9 3.24 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.634 0.774 . . . . 0.0 111.059 173.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.07 -54.0 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.602 1.161 . . . . 0.0 111.141 -173.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 64.6 mt -80.61 -14.53 58.1 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 64.22 62.0 0.87 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.835 1.254 . . . . 0.0 110.863 172.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.635 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 1.7 mm? -86.26 -26.09 25.19 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.3 172.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.43 -83.94 0.14 Allowed Glycine 0 C--N 1.348 1.217 0 O-C-N 124.048 0.843 . . . . 0.0 113.256 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.18 -25.67 14.19 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.641 0.776 . . . . 0.0 111.025 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.635 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.26 -28.03 68.4 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.209 0.603 . . . . 0.0 111.078 -175.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.3 pttt -58.76 -34.0 70.91 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.228 0.611 . . . . 0.0 111.369 173.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -90.81 -10.61 42.16 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.98 0.912 . . . . 0.0 111.803 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.5 t -97.51 -7.06 32.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.701 0.401 . . . . 0.0 111.52 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -103.07 147.57 26.8 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 49.8 p -113.82 -172.56 2.11 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.673 0.789 . . . . 0.0 110.653 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.88 -53.46 57.04 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 123.313 0.645 . . . . 0.0 111.658 -178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -69.54 -5.46 24.41 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -77.95 150.42 34.0 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-O 121.014 0.435 . . . . 0.0 110.365 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.408 ' HB ' ' HB2' ' A' ' 33' ' ' ASN . 90.2 t -83.49 151.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.928 -174.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.428 HD12 HD23 ' A' ' 73' ' ' LEU . 95.1 mt -114.82 -62.53 1.59 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.024 0.53 . . . . 0.0 109.614 173.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.444 ' HG ' HD12 ' A' ' 37' ' ' LEU . 3.4 tt -65.61 110.48 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.77 -40.71 2.37 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 116.366 -0.379 . . . . 0.0 112.522 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.408 ' HB2' ' HB ' ' A' ' 29' ' ' VAL . 62.6 t30 -77.63 -40.71 40.96 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.13 0.49 . . . . 0.0 110.54 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.54 HG22 ' H ' ' A' ' 36' ' ' GLU . 39.8 mm -84.51 121.92 75.01 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 175.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.05 -17.42 31.77 Favored 'Trans proline' 0 C--N 1.371 1.744 0 C-N-CA 122.648 2.232 . . . . 0.0 112.155 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 19.5 mm-40 -93.92 -12.53 28.63 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.987 0.915 . . . . 0.0 111.389 -172.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.444 HD12 ' HG ' ' A' ' 31' ' ' LEU . 2.9 tm? -76.92 94.89 4.0 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.509 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 16.6 t70 -132.45 -168.82 2.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.184 0.994 . . . . 0.0 110.005 -171.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.558 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -56.07 -72.92 0.07 Allowed 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 125.988 1.715 . . . . 0.0 114.599 -170.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.45 -21.11 62.83 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 121.165 -0.959 . . . . 0.0 110.845 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.509 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -68.37 -34.62 76.39 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.342 177.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 39' ' ' SER . 34.3 m -70.58 -38.06 72.07 Favored 'Isoleucine or valine' 0 C--N 1.372 1.556 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -59.46 -43.34 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.417 0.627 . . . . 0.0 110.161 176.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.26 -45.94 85.91 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.053 -1.43 . . . . 0.0 111.482 -175.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.74 -33.62 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-O 118.894 -0.574 . . . . 0.0 111.533 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.524 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.5 mt -60.42 -52.25 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 40.1 m -54.18 -46.23 72.31 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 124.646 1.217 . . . . 0.0 110.224 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.404 ' O ' ' HD2' ' A' ' 52' ' ' TYR . . . -59.89 -42.77 94.55 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.073 0.949 . . . . 0.0 112.251 178.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.402 HD11 HG22 ' A' ' 7' ' ' VAL . 3.6 mm? -55.84 -46.82 78.07 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.348 0.659 . . . . 0.0 110.213 175.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.1 mm-40 -56.82 -45.89 82.01 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 124.128 0.892 . . . . 0.0 110.529 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 47' ' ' THR . 67.2 mm-40 -59.09 -64.11 1.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 O-C-N 124.245 0.966 . . . . 0.0 111.281 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.404 ' HD2' ' O ' ' A' ' 48' ' ' ALA . 83.1 m-85 -66.96 -37.46 84.3 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.653 0.781 . . . . 0.0 112.719 -169.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.403 ' HB2' ' CE1' ' A' ' 55' ' ' PHE . 37.6 m-85 -91.65 -6.05 52.82 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 119.35 -0.357 . . . . 0.0 111.797 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 63.11 34.63 13.53 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.298 1.039 . . . . 0.0 111.841 169.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -135.14 -171.98 2.94 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.407 -175.098 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.8 t -135.66 126.21 26.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.42 0.288 . . . . 0.0 110.481 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.3 t -77.53 132.93 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.447 ' O ' HG13 ' A' ' 62' ' ' ILE . 20.5 t70 -71.81 143.72 49.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.04 0.536 . . . . 0.0 110.52 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.7 -41.64 82.12 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.888 0.875 . . . . 0.0 112.1 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -75.56 1.4 14.42 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.918 0.887 . . . . 0.0 112.516 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.92 -11.09 8.99 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.696 0.398 . . . . 0.0 111.43 172.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 58' ' ' ASP . 50.9 mt -82.37 113.86 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.7 t -136.09 175.15 9.87 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.869 0.868 . . . . 0.0 109.216 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.69 76.5 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 170.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -64.89 -21.36 66.8 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.59 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 58.3 m -68.11 -36.74 80.24 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.848 0.459 . . . . 0.0 110.356 177.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.598 ' HA ' HD21 ' A' ' 73' ' ' LEU . 87.2 m-85 -95.67 16.63 16.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.978 0.511 . . . . 0.0 112.305 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -61.88 -46.67 88.38 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.227 0.33 . . . . 0.0 110.88 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.0 p -139.48 163.44 32.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.958 0.903 . . . . 0.0 110.407 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.4 tp -64.93 -31.01 72.04 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.581 0.752 . . . . 0.0 110.909 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.67 -29.54 69.49 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.716 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.0 m -64.1 -52.94 56.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.996 0.519 . . . . 0.0 110.3 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.598 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -59.3 -45.36 91.49 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 123.316 0.385 . . . . 0.0 110.811 177.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.37 87.06 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.195 0.934 . . . . 0.0 111.094 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -61.05 -53.46 56.92 Favored 'General case' 0 C--N 1.352 0.674 0 O-C-N 123.744 0.652 . . . . 0.0 109.809 178.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.482 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.2 m-85 -55.29 -52.65 62.75 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.152 0.908 . . . . 0.0 111.586 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.4 m -65.27 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 123.355 0.409 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.34 -18.65 59.94 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.607 0.363 . . . . 0.0 111.731 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -80.29 -37.86 31.91 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.314 0.506 . . . . 0.0 109.662 171.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.6 mmmt -62.57 -58.32 7.99 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.095 0.958 . . . . 0.0 111.765 -176.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.02 -14.91 62.51 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.105 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 N--CA 1.482 1.152 0 C-N-CA 122.932 0.493 . . . . 0.0 111.624 176.572 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.106 0.479 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -96.09 -55.04 3.09 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -70.85 -10.17 59.04 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.226 -1.352 . . . . 0.0 114.125 -165.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.0 -34.64 43.63 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.64 -34.87 67.6 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 120.825 0.345 . . . . 0.0 110.487 -175.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.71 -30.6 56.74 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.63 0.772 . . . . 0.0 110.71 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 95.5 t -67.02 -47.93 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -72.64 -26.0 61.49 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 122.662 0.385 . . . . 0.0 110.717 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.45 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.7 t30 -62.25 -47.55 83.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.158 0.583 . . . . 0.0 109.577 171.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.86 -47.44 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.979 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.63 -38.83 89.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.237 0.615 . . . . 0.0 110.534 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.568 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.84 -19.69 78.3 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.815 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -84.28 -52.06 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.404 0.682 . . . . 0.0 110.975 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.5 t -69.72 -49.28 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.906 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.581 HD11 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -90.89 -6.51 54.07 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.144 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 64.61 65.62 0.63 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.126 0.97 . . . . 0.0 111.298 174.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.568 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 8.8 mp -85.75 -38.81 17.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.62 0.768 . . . . 0.0 110.799 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.68 -90.38 0.56 Allowed Glycine 0 C--N 1.35 1.322 0 O-C-N 123.31 0.381 . . . . 0.0 112.652 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.31 -19.92 16.81 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.903 0.881 . . . . 0.0 110.454 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -64.87 -31.95 73.43 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.459 0.704 . . . . 0.0 109.801 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.8 pttt -68.97 -32.88 72.78 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.793 0.437 . . . . 0.0 110.765 174.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -79.84 -29.75 40.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.171 0.589 . . . . 0.0 110.659 -173.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 t -81.63 -16.28 51.95 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.943 -177.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 pp -95.54 155.92 16.54 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.72 0.295 . . . . 0.0 110.867 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.5 p -117.65 -172.35 2.22 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.263 1.025 . . . . 0.0 111.086 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.21 75.39 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.345 0.658 . . . . 0.0 111.779 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -80.19 3.84 19.41 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.546 0.738 . . . . 0.0 112.266 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.2 t -75.38 136.65 40.77 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.691 0.396 . . . . 0.0 110.408 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.03 147.57 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.7 mt -108.26 -67.78 0.95 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 122.243 -0.286 . . . . 0.0 110.365 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.4 mt -56.73 116.33 3.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.812 0.445 . . . . 0.0 111.07 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.66 -23.43 19.64 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-N 115.331 -0.849 . . . . 0.0 113.807 176.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -77.2 -55.85 5.07 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 170.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 24.8 mm -76.52 118.08 69.04 Favored Pre-proline 0 C--O 1.241 0.634 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 176.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.48 -4.38 14.96 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.541 2.161 . . . . 0.0 112.517 -173.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.535 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 46.7 mm-40 -105.98 -15.85 14.79 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.972 0.909 . . . . 0.0 111.157 -175.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.0 tp -80.36 87.98 5.59 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 110.112 -175.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -99.62 -171.02 1.98 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.934 0.893 . . . . 0.0 111.201 174.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 42' ' ' VAL . 78.0 p -66.12 -53.05 42.69 Favored 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.454 1.101 . . . . 0.0 112.096 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -59.64 -30.52 68.79 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.709 0.766 . . . . 0.0 110.578 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.581 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -69.14 -26.91 65.12 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.634 174.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 39' ' ' SER . 2.2 m -65.8 -38.34 81.99 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.5 t -62.61 -47.05 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 CA-C-O 121.259 0.552 . . . . 0.0 110.041 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.67 -51.47 68.65 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.797 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.6 m -68.26 -35.91 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.401 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.553 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -62.31 -45.77 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 54.3 m -57.87 -46.14 85.3 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 124.064 0.853 . . . . 0.0 110.595 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.0 -37.08 86.12 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -57.89 -50.67 72.54 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.236 0.614 . . . . 0.0 109.661 172.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.8 mm-40 -50.55 -51.21 50.02 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.61 1.164 . . . . 0.0 110.78 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' THR . 12.5 mm-40 -65.58 -53.49 41.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.454 -174.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -65.66 -46.24 79.91 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.51 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 2.9 m-85 -91.52 -13.8 31.48 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.628 -175.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 65.65 39.96 4.66 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.448 1.099 . . . . 0.0 111.418 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.51 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -131.94 179.36 6.13 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.686 0.794 . . . . 0.0 110.085 -177.108 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.9 t -130.53 112.22 12.99 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.988 0.18 . . . . 0.0 111.25 175.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.479 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.3 t -70.36 114.08 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.494 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.5 t70 -69.03 147.24 51.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 -168.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.041 0.536 . . . . 0.0 112.408 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.92 -7.97 39.9 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.788 0.835 . . . . 0.0 113.233 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -115.02 -11.66 12.09 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.987 0.515 . . . . 0.0 111.825 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 58' ' ' ASP . 51.9 mt -88.51 125.51 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 120.737 0.303 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.7 t -143.49 176.95 8.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.784 1.234 . . . . 0.0 108.948 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.99 -32.16 73.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.692 0.758 . . . . 0.0 109.38 167.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -69.2 -16.31 63.58 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 114.598 -1.183 . . . . 0.0 111.485 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 88.5 m -74.85 -39.2 61.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.405 0.682 . . . . 0.0 109.699 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.558 ' HA ' HD21 ' A' ' 73' ' ' LEU . 96.4 m-85 -93.96 17.29 12.52 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.848 0.859 . . . . 0.0 112.751 -176.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.08 -46.58 83.66 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 122.135 0.174 . . . . 0.0 110.688 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.1 p -138.35 161.11 37.77 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.44 0.696 . . . . 0.0 111.301 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.6 tp -57.75 -42.66 84.4 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.0 0.92 . . . . 0.0 110.816 175.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.62 -31.08 78.67 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.497 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -63.09 -53.59 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.968 0.507 . . . . 0.0 110.401 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.558 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.9 mm? -57.57 -42.58 83.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.4 0.438 . . . . 0.0 110.119 177.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.558 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.45 -42.45 98.79 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.43 -177.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -48.29 78.26 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.098 0.559 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.531 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 37.2 m-85 -53.59 -54.6 35.27 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 123.733 0.646 . . . . 0.0 110.26 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.51 -25.85 34.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.109 0.563 . . . . 0.0 112.372 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 62.8 mm-40 -56.97 -51.45 69.17 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 169.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -67.3 -30.36 70.19 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.835 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.7 mmmt -64.63 -56.88 11.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.613 0.765 . . . . 0.0 112.226 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.2 -13.37 62.37 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.333 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 122.859 0.463 . . . . 0.0 110.638 169.884 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.414 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.861 0.362 . . . . 0.0 110.173 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . 0.46 HE21 ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -99.23 -37.55 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.267 1.027 . . . . 0.0 110.467 177.076 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -70.96 -22.01 62.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -168.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -51.9 -31.74 29.65 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.032 0.933 . . . . 0.0 113.138 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' HG3' ' HE ' ' A' ' 8' ' ' ARG . 37.3 tt0 -75.12 -40.31 59.94 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 122.87 0.468 . . . . 0.0 111.25 -175.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.65 -28.61 64.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.992 0.517 . . . . 0.0 111.03 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.472 HG22 HD11 ' A' ' 49' ' ' LEU . 90.0 t -66.9 -49.24 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 41.8 ptt180 -71.03 -25.12 62.52 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.543 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.2 t30 -61.85 -49.32 76.76 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 123.335 0.654 . . . . 0.0 109.318 173.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.0 mt -60.54 -51.44 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.633 177.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.9 -34.24 77.69 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.224 0.21 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.587 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -72.4 -21.46 79.4 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-O 120.196 -0.224 . . . . 0.0 113.262 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.02 -57.14 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.4 0.68 . . . . 0.0 110.176 176.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 97.1 t -71.11 -47.38 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.741 1.216 . . . . 0.0 110.534 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.43 HD11 HD13 ' A' ' 37' ' ' LEU . 44.1 mt -83.46 -6.5 59.47 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.553 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 63.41 59.91 1.19 Allowed 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.58 1.152 . . . . 0.0 110.916 172.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.7 mp -89.65 -29.61 18.69 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.45 173.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.0 -89.88 0.21 Allowed Glycine 0 C--N 1.351 1.406 0 O-C-N 123.978 0.799 . . . . 0.0 112.31 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -101.17 -18.94 15.95 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.928 0.891 . . . . 0.0 110.857 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.86 -26.93 69.01 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.233 0.613 . . . . 0.0 111.095 -177.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.1 pttt -62.87 -34.91 78.36 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 123.246 0.618 . . . . 0.0 111.313 173.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -69.7 -29.1 66.43 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.386 1.074 . . . . 0.0 110.995 -176.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -93.26 -6.57 47.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -174.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -99.34 153.53 18.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 176.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.2 p -112.9 -176.07 2.81 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 111.184 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.95 -50.24 74.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.796 0.838 . . . . 0.0 110.668 173.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.1 m -71.54 -12.48 61.39 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.205 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -69.75 140.93 53.5 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 123.311 0.644 . . . . 0.0 110.168 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 63.6 t -79.37 152.21 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.364 1.066 . . . . 0.0 109.848 -176.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.28 -65.74 1.16 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.437 0.695 . . . . 0.0 109.862 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.1 mt -60.56 111.71 1.7 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.05 0.452 . . . . 0.0 110.703 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 103.03 -30.53 10.23 Favored Glycine 0 C--N 1.333 0.416 0 CA-C-N 115.061 -0.972 . . . . 0.0 112.79 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -79.54 -53.61 6.7 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.005 0.431 . . . . 0.0 110.058 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.441 HG22 ' H ' ' A' ' 36' ' ' GLU . 26.8 mm -87.29 120.82 71.45 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.72 -14.83 33.36 Favored 'Trans proline' 0 C--N 1.372 1.765 0 C-N-CA 122.39 2.06 . . . . 0.0 112.22 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.441 ' H ' HG22 ' A' ' 34' ' ' ILE . 19.6 mm-40 -85.83 -18.23 33.47 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 -174.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.43 HD13 HD11 ' A' ' 15' ' ' LEU . 40.2 tp -83.28 80.18 9.16 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 122.036 0.922 . . . . 0.0 110.272 -175.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -93.8 177.31 6.04 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.976 1.71 . . . . 0.0 109.681 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.662 ' O ' HG22 ' A' ' 42' ' ' VAL . 3.6 m -44.34 -64.11 0.75 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.827 1.251 . . . . 0.0 113.35 170.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.8 mmt -65.92 -26.83 67.78 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 121.512 -0.742 . . . . 0.0 111.236 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.18 -38.32 87.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.286 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 39' ' ' SER . 15.1 m -67.07 -35.06 73.52 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 176.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 t -62.17 -48.49 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 121.688 0.756 . . . . 0.0 110.177 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -59.62 -46.36 89.2 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 113.656 -1.611 . . . . 0.0 112.475 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.7 m -73.67 -30.86 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.127 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.455 HD13 HD13 ' A' ' 62' ' ' ILE . 96.4 mt -63.41 -48.77 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.7 m -55.84 -47.01 77.99 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.421 1.076 . . . . 0.0 110.153 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 -40.67 97.3 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.864 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD11 HG22 ' A' ' 7' ' ' VAL . 2.1 mm? -56.16 -49.91 72.63 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.284 0.564 . . . . 0.0 109.858 175.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -63.53 -38.67 92.0 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.594 -1.185 . . . . 0.0 112.249 -178.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -66.77 -54.57 21.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.406 0.682 . . . . 0.0 111.072 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -57.63 -57.6 12.01 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.788 0.835 . . . . 0.0 111.325 -177.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -82.55 -15.01 53.9 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.204 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 64.0 58.84 1.15 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.854 0.862 . . . . 0.0 111.427 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.472 ' CE2' HG22 ' A' ' 57' ' ' VAL . 8.9 p90 -142.95 -177.69 5.46 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.311 173.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.3 m -131.0 121.19 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.882 0.473 . . . . 0.0 110.311 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.472 HG22 ' CE2' ' A' ' 55' ' ' PHE . 2.1 t -77.69 127.31 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 29.4 t70 -89.83 153.75 20.42 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 122.799 0.44 . . . . 0.0 110.651 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -58.41 -34.29 70.6 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.043 0.937 . . . . 0.0 113.223 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -59.75 -33.76 72.08 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.837 0.855 . . . . 0.0 112.156 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.0 pt-20 -97.99 -15.86 19.91 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.462 0.705 . . . . 0.0 110.822 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.455 HD13 HD13 ' A' ' 46' ' ' ILE . 38.4 mt -83.84 119.7 33.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 123.09 0.556 . . . . 0.0 111.061 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 82.9 p -155.29 -172.0 4.01 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.055 0.942 . . . . 0.0 109.378 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.48 -29.72 69.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.058 0.456 . . . . 0.0 110.38 171.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -67.94 -13.44 62.16 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.832 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.1 m -79.26 -41.47 28.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 0.0 110.105 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.466 ' HA ' HD21 ' A' ' 73' ' ' LEU . 78.6 m-85 -99.31 15.53 25.91 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.94 -49.6 76.8 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 123.055 0.222 . . . . 0.0 110.904 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 74.5 p -138.14 164.29 29.53 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.534 0.734 . . . . 0.0 110.515 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 tp -62.82 -34.5 77.44 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.205 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.02 -31.91 79.29 Favored Glycine 0 C--N 1.341 0.85 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.399 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -62.57 -53.01 61.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.164 0.586 . . . . 0.0 110.103 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.466 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.48 -41.91 81.63 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 123.357 0.41 . . . . 0.0 110.612 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.558 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.22 -44.95 92.29 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 124.048 0.843 . . . . 0.0 110.891 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.84 -54.95 41.08 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.195 0.998 . . . . 0.0 110.118 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 66.2 m-85 -53.83 -55.87 22.7 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.013 0.82 . . . . 0.0 110.753 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 19.6 m -66.48 -25.98 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 79.3 mm-40 -59.17 -52.67 64.7 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -60.8 -38.99 87.23 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.102 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.515 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -67.93 -52.43 36.23 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.598 0.759 . . . . 0.0 111.606 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.37 -17.96 62.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.989 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 CA--C 1.547 0.839 0 C-N-CA 122.819 0.448 . . . . 0.0 111.059 171.567 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.99 -21.52 15.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.414 0.686 . . . . 0.0 111.402 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -90.72 -14.84 31.36 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 118.209 -0.901 . . . . 0.0 113.086 -174.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.52 -28.22 43.77 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 118.785 0.721 . . . . 0.0 112.203 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 39.3 tt0 -67.97 -46.84 70.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.764 0.825 . . . . 0.0 110.601 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.61 70.43 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.426 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 89.2 t -66.26 -48.38 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 122.864 0.465 . . . . 0.0 109.788 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 5' ' ' GLU . 37.1 ptt180 -69.08 -26.76 65.1 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 123.533 0.521 . . . . 0.0 110.144 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -61.42 -51.39 68.92 Favored 'General case' 0 C--N 1.351 0.644 0 C-N-CA 123.532 0.733 . . . . 0.0 109.506 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.5 mt -62.73 -49.12 84.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.105 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.84 -45.9 87.44 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.06 0.544 . . . . 0.0 111.047 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.493 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -69.93 -18.42 74.4 Favored Glycine 0 C--N 1.337 0.605 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.442 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -81.14 -53.22 6.57 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 117.293 0.546 . . . . 0.0 110.228 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.65 -49.8 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 124.066 0.946 . . . . 0.0 111.141 -173.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.531 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -82.76 -7.4 59.66 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.892 0.477 . . . . 0.0 111.159 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 t30 62.23 64.03 1.01 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.668 1.187 . . . . 0.0 111.644 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.555 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 9.6 mp -88.66 -31.43 18.52 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.91 170.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.93 -99.62 0.5 Allowed Glycine 0 C--N 1.352 1.431 0 O-C-N 123.552 0.533 . . . . 0.0 113.617 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.15 -23.18 35.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.056 0.943 . . . . 0.0 110.689 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.555 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.56 -30.21 69.78 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 122.944 0.498 . . . . 0.0 111.234 -175.384 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.493 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.1 pttt -65.15 -26.21 68.08 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 120.689 0.281 . . . . 0.0 111.341 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -79.5 -33.74 41.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.265 0.626 . . . . 0.0 110.691 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 t -83.2 -8.59 59.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -173.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.4 pp -96.23 166.78 11.57 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 120.969 0.414 . . . . 0.0 110.524 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 73.3 p -115.1 -178.91 3.48 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.113 0.965 . . . . 0.0 110.335 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.89 -14.94 57.46 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.139 0.576 . . . . 0.0 112.209 174.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.4 t -90.9 8.25 35.99 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.045 0.538 . . . . 0.0 111.587 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 94.1 p -78.87 121.2 24.54 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.62 0.368 . . . . 0.0 110.15 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.02 145.71 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.458 ' HA ' HG12 ' A' ' 34' ' ' ILE . 55.2 mt -101.69 -70.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.6 mt -57.94 114.95 2.56 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 122.954 0.501 . . . . 0.0 111.393 178.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.05 -38.1 3.22 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.121 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -75.92 -51.99 11.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.906 0.482 . . . . 0.0 109.913 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.458 HG12 ' HA ' ' A' ' 30' ' ' LEU . 19.6 mm -79.08 112.23 26.24 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 175.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.34 2.27 8.62 Favored 'Trans proline' 0 C--N 1.369 1.652 0 C-N-CA 122.764 2.309 . . . . 0.0 112.113 -177.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 23.4 mm-40 -97.12 -19.41 18.69 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 123.802 0.841 . . . . 0.0 109.688 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.34 96.86 6.79 Favored 'General case' 0 C--N 1.352 0.697 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -90.77 173.87 7.78 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.801 1.24 . . . . 0.0 109.615 172.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.615 ' O ' HG22 ' A' ' 42' ' ' VAL . 86.6 p -59.21 -49.13 79.01 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.508 0.723 . . . . 0.0 111.081 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.3 mmt -60.51 -31.19 70.26 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.9 -0.5 . . . . 0.0 110.724 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.531 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -69.57 -29.01 66.48 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.346 176.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 39' ' ' SER . 2.3 m -63.8 -37.2 79.09 Favored 'Isoleucine or valine' 0 C--N 1.372 1.584 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.8 t -66.92 -47.46 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.174 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.59 -42.78 88.84 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.031 -1.441 . . . . 0.0 112.173 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -75.7 -31.01 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.654 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.578 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.8 mt -59.79 -54.43 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 172.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 37.7 m -51.37 -49.2 61.96 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 124.673 1.233 . . . . 0.0 110.868 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.78 -43.78 98.18 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.014 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -55.59 -47.97 75.61 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.144 0.578 . . . . 0.0 110.333 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -59.4 -43.83 92.91 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.983 0.913 . . . . 0.0 111.241 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' THR . 33.2 mm-40 -65.12 -59.12 4.46 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.597 0.759 . . . . 0.0 111.097 -177.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -67.34 -44.85 78.06 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.554 0.741 . . . . 0.0 112.288 -171.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -82.56 -21.14 35.42 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 119.402 -0.332 . . . . 0.0 111.309 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.7 t70 64.03 64.1 0.77 Allowed 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.261 1.024 . . . . 0.0 110.615 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.02 -174.3 4.93 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.7 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -130.49 119.96 23.41 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.217 0.607 . . . . 0.0 110.698 170.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.2 t -70.72 126.37 30.84 Favored 'Isoleucine or valine' 0 C--N 1.353 0.755 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 165.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.3 t70 -73.54 144.57 46.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 122.564 0.346 . . . . 0.0 110.848 -174.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -51.16 -42.66 60.95 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.067 0.947 . . . . 0.0 112.973 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.83 -19.91 63.45 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.798 0.839 . . . . 0.0 112.701 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.2 pt-20 -102.55 -7.4 21.88 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.82 0.448 . . . . 0.0 111.15 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 58' ' ' ASP . 75.4 mt -85.81 105.39 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.7 t -133.16 170.57 15.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.016 0.926 . . . . 0.0 109.599 174.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.72 -32.11 71.38 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.472 0.654 . . . . 0.0 109.996 170.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.74 -12.58 61.38 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.599 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.416 HG22 HD13 ' A' ' 73' ' ' LEU . 42.1 m -74.72 -42.18 58.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.577 ' HA ' HD21 ' A' ' 73' ' ' LEU . 92.2 m-85 -92.72 20.94 5.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.096 0.958 . . . . 0.0 112.31 -176.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.458 ' HG3' HG22 ' A' ' 69' ' ' THR . 7.6 pt-20 -65.14 -45.21 85.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.292 0.237 . . . . 0.0 110.633 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.458 HG22 ' HG3' ' A' ' 68' ' ' GLU . 11.5 t -150.13 158.53 44.25 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.064 0.546 . . . . 0.0 110.873 -179.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 tp -52.33 -40.34 61.8 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.547 1.139 . . . . 0.0 111.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.96 -41.82 96.52 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 114.607 -1.179 . . . . 0.0 111.794 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.425 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 50.5 m -60.1 -50.29 74.3 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.001 0.52 . . . . 0.0 111.035 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.577 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -58.06 -40.17 80.31 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 122.604 0.361 . . . . 0.0 110.395 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.555 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.92 -48.64 80.9 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.308 1.005 . . . . 0.0 110.632 178.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.12 -45.59 87.03 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 124.042 0.937 . . . . 0.0 111.002 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.481 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.5 m-85 -56.71 -57.35 12.79 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.294 177.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.7 m -67.6 -23.11 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.3 mm-40 -57.39 -51.28 70.06 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.48 -51.84 63.88 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.312 -176.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.57 -48.49 79.21 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 0.0 112.451 -171.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -78.1 -16.72 57.74 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.155 -178.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 122.82 0.448 . . . . 0.0 111.493 172.231 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 121.437 0.637 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . 0.472 ' HA ' HE21 ' A' ' 2' ' ' GLN . 0.0 OUTLIER -95.1 -46.59 6.73 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.152 171.279 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -74.83 -17.72 60.56 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 113.549 -1.659 . . . . 0.0 113.507 -164.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.24 -37.72 37.06 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.991 0.916 . . . . 0.0 112.487 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -75.17 -41.1 58.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.712 -174.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.54 66.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.367 0.667 . . . . 0.0 111.414 174.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.7 t -70.46 -50.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.082 0.553 . . . . 0.0 109.536 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -67.08 -27.41 67.34 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.32 -58.56 6.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.011 0.924 . . . . 0.0 109.727 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.405 ' O ' HG23 ' A' ' 14' ' ' VAL . 95.3 mt -61.28 -49.77 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.951 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.12 -41.78 89.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.308 0.643 . . . . 0.0 111.126 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.527 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.61 -19.99 79.69 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 121.556 -0.354 . . . . 0.0 113.42 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -75.73 -48.64 21.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.949 0.5 . . . . 0.0 110.446 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 10' ' ' ILE . 57.3 t -67.47 -48.63 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 123.523 0.729 . . . . 0.0 110.38 -177.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.511 ' HB2' HD13 ' A' ' 17' ' ' LEU . 44.2 mt -84.5 0.04 51.25 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.227 -177.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 66.76 24.84 9.83 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.366 1.066 . . . . 0.0 111.507 170.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.511 HD13 ' HB2' ' A' ' 15' ' ' LEU . 9.6 mp -60.11 -41.31 92.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.222 0.609 . . . . 0.0 110.706 174.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.16 -81.68 0.03 OUTLIER Glycine 0 C--N 1.354 1.546 0 O-C-N 124.196 0.935 . . . . 0.0 114.089 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -87.47 -35.83 18.02 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.026 0.93 . . . . 0.0 110.252 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.09 -28.29 69.98 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.123 0.969 . . . . 0.0 110.904 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.527 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 54.9 pttt -70.33 -31.99 69.53 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.806 0.442 . . . . 0.0 111.864 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -80.02 -31.5 39.6 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.102 0.561 . . . . 0.0 110.726 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.1 t -85.65 -5.88 59.21 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.207 0.603 . . . . 0.0 112.45 -175.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -98.07 155.99 16.87 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.236 0.471 . . . . 0.0 110.084 176.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.8 p -112.94 -175.64 2.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.619 0.767 . . . . 0.0 110.921 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -35.77 76.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.273 0.629 . . . . 0.0 110.944 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.6 m -75.95 -15.8 60.11 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.368 -0.833 . . . . 0.0 112.242 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.9 p -67.82 140.63 56.61 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.859 0.299 . . . . 0.0 110.825 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -84.26 143.06 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 123.782 0.833 . . . . 0.0 109.341 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.428 ' HA ' HG12 ' A' ' 34' ' ' ILE . 49.2 mt -110.35 -70.27 0.82 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.828 0.451 . . . . 0.0 109.873 178.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.01 112.52 1.22 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.393 1.077 . . . . 0.0 110.699 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 -40.47 2.48 Favored Glycine 0 C--N 1.345 1.081 0 O-C-N 123.541 0.526 . . . . 0.0 112.745 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -78.14 -59.07 2.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.262 0.625 . . . . 0.0 110.475 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.456 HG22 ' H ' ' A' ' 36' ' ' GLU . 31.9 mm -76.26 120.28 80.96 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.32 -13.38 35.69 Favored 'Trans proline' 0 C--N 1.37 1.699 0 C-N-CA 122.726 2.284 . . . . 0.0 112.441 -177.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.456 ' H ' HG22 ' A' ' 34' ' ' ILE . 21.8 mm-40 -86.75 -13.92 43.87 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.53 0.732 . . . . 0.0 111.27 -177.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.41 81.7 5.64 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 17.5 t70 -96.04 170.88 8.97 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.65 1.58 . . . . 0.0 109.92 178.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.627 ' O ' HG22 ' A' ' 42' ' ' VAL . 6.1 m -46.56 -67.81 0.25 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.712 1.205 . . . . 0.0 113.019 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.0 mmm -66.13 -24.07 66.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.801 -0.562 . . . . 0.0 111.501 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.423 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -65.42 -37.06 85.82 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 124.069 0.856 . . . . 0.0 112.251 174.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.627 HG22 ' O ' ' A' ' 39' ' ' SER . 7.7 m -68.7 -37.61 77.77 Favored 'Isoleucine or valine' 0 C--N 1.367 1.347 0 CA-C-N 118.445 0.566 . . . . 0.0 109.776 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -61.18 -45.29 98.88 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.592 0.711 . . . . 0.0 109.374 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.4 -50.14 74.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 113.605 -1.634 . . . . 0.0 113.085 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.7 m -71.82 -30.51 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.619 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -63.48 -50.59 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.3 m -53.24 -48.68 68.01 Favored 'General case' 0 C--N 1.351 0.656 0 O-C-N 124.421 1.076 . . . . 0.0 110.929 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.41 -43.74 98.1 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.115 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -57.13 -46.5 82.63 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.463 0.705 . . . . 0.0 110.59 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.88 -44.64 91.16 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.034 0.934 . . . . 0.0 111.222 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 47' ' ' THR . 37.6 mm-40 -59.31 -61.34 2.7 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.63 0.772 . . . . 0.0 111.353 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -67.3 -51.56 51.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.874 -171.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 m-30 -75.2 -16.26 60.5 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.522 0.329 . . . . 0.0 111.551 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.0 t70 68.12 66.73 0.34 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.268 1.027 . . . . 0.0 110.63 175.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.481 ' CE2' HG22 ' A' ' 57' ' ' VAL . 7.7 p90 -157.01 -170.28 3.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.015 172.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.88 138.66 45.71 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 167.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.481 HG22 ' CE2' ' A' ' 55' ' ' PHE . 2.9 t -89.69 122.69 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 176.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' ILE . 18.0 t70 -87.93 153.79 21.02 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.674 0.79 . . . . 0.0 111.281 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.67 -36.9 67.61 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.548 1.139 . . . . 0.0 112.365 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.35 -33.55 76.23 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.228 1.011 . . . . 0.0 111.844 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -96.87 -20.68 17.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.941 0.496 . . . . 0.0 110.918 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' ASP . 53.7 mt -74.76 124.51 32.61 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 174.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.5 t -146.13 -178.7 6.27 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.39 1.076 . . . . 0.0 108.474 165.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.41 74.06 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.401 0.619 . . . . 0.0 109.574 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -65.94 -12.28 53.63 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.837 178.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 91.6 m -72.9 -38.17 67.0 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.009 0.523 . . . . 0.0 110.489 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.524 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.6 m-85 -97.75 7.05 47.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.16 -47.85 77.44 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.376 0.422 . . . . 0.0 111.232 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.6 p -135.8 166.33 23.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.964 0.506 . . . . 0.0 110.868 173.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.9 tp -59.57 -38.05 80.11 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.072 174.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.1 -35.08 90.96 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.87 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -62.28 -53.08 60.32 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.012 0.525 . . . . 0.0 110.574 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.524 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -56.43 -43.48 79.46 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.508 0.505 . . . . 0.0 110.071 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.58 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.92 -48.13 82.57 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 124.589 1.18 . . . . 0.0 111.667 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 75' ' ' LEU . 2.4 mm? -66.96 -39.03 87.15 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.423 0.452 . . . . 0.0 110.94 -179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.495 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 24.5 m-85 -57.68 -54.72 43.66 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 176.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.44 -24.38 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.099 0.56 . . . . 0.0 112.051 -178.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.6 mm-40 -57.47 -56.01 27.42 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -60.19 -34.94 74.32 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.546 -174.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 30.9 mmmt -63.85 -56.71 13.33 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.344 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.456 HD22 ' HB2' ' A' ' 80' ' ' LYS . 3.1 mm? -84.22 -13.26 53.15 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -173.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -175.151 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.453 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . 0.409 HE21 ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -99.11 -36.22 9.76 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.035 0.934 . . . . 0.0 110.799 177.298 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.83 -17.57 61.05 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -169.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -51.99 -33.04 36.42 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 123.809 0.844 . . . . 0.0 112.581 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 -41.78 63.96 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.205 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.5 -28.95 65.36 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.917 0.487 . . . . 0.0 111.053 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.3 t -67.54 -50.55 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 122.994 0.517 . . . . 0.0 109.927 176.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -67.52 -28.62 67.97 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -60.26 -52.89 63.37 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 123.966 0.791 . . . . 0.0 109.749 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 49' ' ' LEU . 85.7 mt -62.92 -55.33 24.3 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 O-C-N 124.219 0.949 . . . . 0.0 111.492 -178.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.64 -34.65 78.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.742 0.417 . . . . 0.0 111.495 -175.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.478 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -78.91 -20.05 71.46 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-O 119.989 -0.34 . . . . 0.0 113.689 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.18 -48.01 25.63 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.033 0.533 . . . . 0.0 109.705 173.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.434 HG13 ' ND2' ' A' ' 44' ' ' ASN . 71.2 t -70.17 -49.77 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.466 1.106 . . . . 0.0 110.929 -176.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -78.21 -9.26 59.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.427 0.691 . . . . 0.0 111.255 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 67.02 44.52 1.94 Allowed 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.543 1.137 . . . . 0.0 111.401 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 7.0 mp -72.29 -35.36 68.66 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.54 1.136 . . . . 0.0 110.68 173.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.24 -91.39 0.37 Allowed Glycine 0 C--N 1.346 1.122 0 CA-C-N 115.727 -0.67 . . . . 0.0 113.494 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -97.06 -21.02 17.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.787 0.835 . . . . 0.0 110.754 -177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -61.9 -34.25 75.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.392 0.677 . . . . 0.0 109.893 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 56.9 pttt -68.78 -29.84 68.3 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.224 0.61 . . . . 0.0 111.579 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -75.8 -40.74 54.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.164 0.586 . . . . 0.0 110.313 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -85.87 13.32 7.57 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.215 0.606 . . . . 0.0 112.05 -173.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.6 pp -113.36 163.09 15.29 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 122.011 -0.431 . . . . 0.0 111.206 172.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.9 p -122.81 -173.17 2.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.478 1.111 . . . . 0.0 110.251 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.03 65.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.316 0.646 . . . . 0.0 112.719 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -86.79 0.48 54.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.198 0.599 . . . . 0.0 112.602 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.436 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 97.2 p -73.26 125.68 28.34 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.588 0.355 . . . . 0.0 110.751 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.0 t -76.83 136.22 25.02 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.3 mt -108.6 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.532 0.333 . . . . 0.0 110.229 -175.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.52 117.02 5.64 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.45 -33.12 6.26 Favored Glycine 0 C--N 1.342 0.91 0 CA-C-N 115.855 -0.612 . . . . 0.0 113.151 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -90.54 -44.73 9.38 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.084 0.554 . . . . 0.0 110.983 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.501 HG12 ' HA ' ' A' ' 30' ' ' LEU . 33.7 mm -79.87 120.3 79.46 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -70.72 -13.77 32.54 Favored 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 122.847 2.364 . . . . 0.0 112.927 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.433 ' H ' HG22 ' A' ' 34' ' ' ILE . 8.5 mm-40 -94.11 -11.65 30.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.363 0.665 . . . . 0.0 111.091 -174.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -82.66 88.9 6.69 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' HG13 ' A' ' 42' ' ' VAL . 25.6 t70 -101.63 174.03 6.15 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.309 1.443 . . . . 0.0 108.932 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.588 ' O ' HG22 ' A' ' 42' ' ' VAL . 6.2 m -44.78 -65.33 0.54 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.796 1.238 . . . . 0.0 113.45 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.7 mmm -71.31 -16.68 62.46 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.606 -0.684 . . . . 0.0 111.654 -175.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.82 -33.85 71.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.319 0.648 . . . . 0.0 111.539 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 39' ' ' SER . 2.7 m -68.19 -39.4 81.14 Favored 'Isoleucine or valine' 0 C--N 1.371 1.507 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.9 t -64.85 -43.32 96.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.534 0.683 . . . . 0.0 109.904 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.434 ' ND2' HG13 ' A' ' 14' ' ' VAL . 56.3 t30 -66.02 -39.55 90.32 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.91 -1.496 . . . . 0.0 112.287 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 m -70.38 -39.59 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.036 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 42' ' ' VAL . 92.9 mt -61.4 -43.1 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 CA-C-N 118.257 0.48 . . . . 0.0 110.045 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.468 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 87.8 m -58.86 -45.13 90.84 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.108 175.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.432 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -63.07 -36.75 84.63 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.642 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 10' ' ' ILE . 3.5 mm? -60.35 -40.08 89.45 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.496 0.718 . . . . 0.0 110.103 175.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -57.98 -51.02 71.39 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.005 0.816 . . . . 0.0 110.481 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 47' ' ' THR . 7.5 mm-40 -58.62 -45.1 89.95 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 124.161 0.913 . . . . 0.0 111.473 -173.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.432 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 17.3 m-85 -81.74 -55.98 4.28 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -172.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -83.82 -18.19 38.47 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.0 58.88 2.58 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.339 1.056 . . . . 0.0 111.384 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -129.29 -171.82 2.59 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.431 172.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.1 m -127.8 111.72 13.96 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.628 166.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.1 t -69.47 112.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.358 0.949 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 173.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 32.9 t70 -77.54 151.71 34.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.179 0.592 . . . . 0.0 111.217 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -60.16 -32.94 71.52 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.604 0.761 . . . . 0.0 112.433 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -71.48 -31.85 67.6 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.296 0.638 . . . . 0.0 111.823 -173.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -85.65 -20.54 29.28 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.744 0.418 . . . . 0.0 110.887 -178.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 68.1 mt -73.07 124.06 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.26 0.624 . . . . 0.0 111.039 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 86.2 p -147.91 175.99 10.52 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.193 0.997 . . . . 0.0 109.448 166.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.14 78.84 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.636 0.731 . . . . 0.0 110.194 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -78.75 -8.63 58.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.114 -176.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -70.71 -37.63 73.57 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.628 ' HA ' HD21 ' A' ' 73' ' ' LEU . 55.2 m-85 -97.58 14.71 25.67 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.406 0.682 . . . . 0.0 112.72 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.69 -44.19 96.87 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 0.0 111.0 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 72' ' ' SER . 15.3 t -144.94 162.21 37.44 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.252 0.621 . . . . 0.0 110.428 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.77 -36.85 77.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.106 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.23 -33.86 87.31 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.96 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.407 ' H ' HG23 ' A' ' 69' ' ' THR . 74.4 m -64.67 -53.51 46.31 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 122.89 0.476 . . . . 0.0 110.662 177.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.628 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -59.01 -39.04 80.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.021 0.201 . . . . 0.0 110.477 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.564 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.03 -45.49 86.86 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 124.073 0.858 . . . . 0.0 110.383 176.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.76 -49.76 76.45 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.957 0.903 . . . . 0.0 110.893 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.448 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 72.9 m-85 -61.59 -48.14 82.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.596 0.358 . . . . 0.0 111.037 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 18.2 m -70.17 -26.79 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.512 0.325 . . . . 0.0 111.627 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 77.6 mm-40 -59.37 -51.86 68.11 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -58.69 -37.6 76.43 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 124.097 0.873 . . . . 0.0 112.052 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.0 mmmt -59.76 -54.96 40.17 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.254 0.55 . . . . 0.0 110.853 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.07 -14.01 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.895 -176.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.479 0.982 0 C-N-CA 122.678 0.391 . . . . 0.0 111.567 175.528 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.32 -41.77 8.09 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.135 0.969 . . . . 0.0 108.432 178.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -82.77 -3.91 57.24 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 113.691 -1.595 . . . . 0.0 112.734 -168.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -52.14 -34.32 44.12 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.941 0.897 . . . . 0.0 112.434 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.79 -43.21 63.04 Favored 'General case' 0 C--N 1.352 0.686 0 O-C-N 123.579 0.549 . . . . 0.0 110.355 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.62 -31.96 73.27 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.571 0.348 . . . . 0.0 111.124 176.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 85.1 t -68.53 -46.51 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 122.821 0.448 . . . . 0.0 110.461 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -70.79 -23.12 62.33 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.673 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -63.95 -50.19 69.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.479 HG21 HD22 ' A' ' 49' ' ' LEU . 88.7 mt -61.39 -48.3 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.673 178.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.05 -36.81 85.53 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.052 0.541 . . . . 0.0 110.341 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.532 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.45 -21.05 78.69 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.54 -0.755 . . . . 0.0 113.67 175.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -85.85 -46.01 11.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.952 0.901 . . . . 0.0 111.225 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.7 t -76.86 -55.73 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 123.752 0.821 . . . . 0.0 110.385 -175.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.533 HD11 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -82.93 -9.52 59.26 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.858 -176.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 68.28 63.52 0.36 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.735 1.214 . . . . 0.0 110.796 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.532 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.0 mp -82.01 -36.93 27.3 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.586 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.94 -89.66 0.06 OUTLIER Glycine 0 C--N 1.356 1.688 0 O-C-N 123.632 0.583 . . . . 0.0 113.795 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.94 -40.57 22.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.785 0.834 . . . . 0.0 110.317 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -28.17 63.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.917 1.287 . . . . 0.0 112.298 -170.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.7 4.11 8.45 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -92.16 -46.98 7.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.91 0.484 . . . . 0.0 109.775 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 t -70.48 -29.09 65.54 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.87 -172.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 4.1 pp -84.16 157.42 21.68 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.84 0.456 . . . . 0.0 111.431 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.2 p -137.42 -162.68 1.32 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.357 1.463 . . . . 0.0 108.533 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.83 -23.07 51.04 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.8 m -77.67 -12.02 59.93 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.635 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 35.9 t -62.03 124.74 21.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.742 0.817 . . . . 0.0 111.349 -177.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 67.6 t -74.0 153.97 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 70.9 mt -120.97 -60.11 1.68 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.435 HD23 HD12 ' A' ' 37' ' ' LEU . 33.5 mt -56.73 110.94 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.142 0.577 . . . . 0.0 110.63 169.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.42 -32.56 6.13 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.269 -0.878 . . . . 0.0 113.181 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -76.86 -60.29 2.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.529 0.331 . . . . 0.0 110.18 -179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.519 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 25.1 mm -78.33 116.98 63.46 Favored Pre-proline 0 CA--C 1.542 0.659 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.15 -6.55 18.09 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.324 2.016 . . . . 0.0 112.297 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -97.9 -10.29 24.85 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.69 0.796 . . . . 0.0 111.144 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.8 tm? -79.0 82.81 5.15 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -177.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.425 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 32.0 t70 -101.79 174.34 6.0 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.417 1.487 . . . . 0.0 109.74 176.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.612 ' O ' HG22 ' A' ' 42' ' ' VAL . 0.5 OUTLIER -43.32 -60.52 1.67 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.209 1.404 . . . . 0.0 112.715 166.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.9 mmt -60.83 -32.49 71.87 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 121.135 0.493 . . . . 0.0 110.822 -178.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.533 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -68.74 -29.33 67.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.648 176.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 39' ' ' SER . 3.3 m -66.96 -37.68 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.875 0.761 . . . . 0.0 109.171 174.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 t -67.28 -44.64 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-O 121.543 0.687 . . . . 0.0 109.29 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -58.69 -49.5 77.36 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.059 -1.428 . . . . 0.0 112.532 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -70.35 -39.04 76.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.802 -175.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 89.2 mt -60.15 -46.26 94.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 88.4 m -57.0 -43.32 81.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 124.065 0.853 . . . . 0.0 110.611 174.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.406 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -69.6 -28.19 65.73 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.265 0.626 . . . . 0.0 112.15 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.531 HD12 HG11 ' A' ' 77' ' ' VAL . 3.6 mm? -61.95 -48.11 81.85 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -56.43 -42.83 78.72 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.005 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' THR . 47.3 mm-40 -60.17 -64.34 0.98 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.879 0.872 . . . . 0.0 111.571 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.447 ' HB2' HD11 ' A' ' 10' ' ' ILE . 48.3 m-85 -66.56 -45.78 78.24 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.838 0.711 . . . . 0.0 112.326 -171.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -83.94 -21.68 31.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 66.29 57.93 0.72 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.458 1.103 . . . . 0.0 111.025 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -140.58 179.48 6.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.157 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -126.44 114.89 18.77 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.1 p -72.48 145.77 11.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 124.944 1.298 . . . . 0.0 110.918 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.467 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.1 t70 -87.01 142.22 28.09 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 174.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.4 -36.79 74.29 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -176.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -70.19 -15.98 63.01 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.9 pt-20 -86.91 -33.43 19.72 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.647 0.379 . . . . 0.0 110.34 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 42.9 mt -78.99 129.01 38.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.006 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 t -141.76 -177.68 5.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.957 1.303 . . . . 0.0 107.961 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.73 -27.41 67.6 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -64.84 -13.41 55.99 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.371 1.068 . . . . 0.0 111.659 174.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 89.1 m -76.03 -50.25 15.31 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 170.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.459 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 97.5 m-85 -84.2 8.76 14.71 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.2 pt-20 -60.04 -42.97 95.58 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 122.47 0.308 . . . . 0.0 110.907 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.52 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.0 t -150.82 162.53 40.56 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.418 0.628 . . . . 0.0 112.009 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.7 -37.78 82.82 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.506 -1.224 . . . . 0.0 110.754 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.94 -32.46 84.11 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.86 -177.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 54.9 m -70.17 -51.94 27.3 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.265 177.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.41 -46.62 62.98 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.234 0.54 . . . . 0.0 111.105 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -63.68 -39.18 93.69 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.203 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -47.34 83.02 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.953 0.901 . . . . 0.0 109.628 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.464 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 59.1 m-85 -61.78 -43.51 98.7 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.207 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.531 HG11 HD12 ' A' ' 49' ' ' LEU . 29.9 m -72.87 -23.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-O 119.007 -0.521 . . . . 0.0 112.228 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 65.0 mm-40 -56.19 -51.17 69.0 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 167.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 76' ' ' PHE . 90.6 m-70 -54.33 -49.56 69.44 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.286 0.991 . . . . 0.0 111.832 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 28.1 mmmt -68.18 -43.71 77.53 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -171.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.25 -14.9 52.24 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.699 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.486 1.37 0 C-N-CA 123.173 0.589 . . . . 0.0 112.55 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 tpt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -36.49 79.07 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.801 0.84 . . . . 0.0 113.026 -166.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' ' 7' ' ' VAL . 2.6 m-70 -73.23 -11.56 60.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 118.187 -0.911 . . . . 0.0 112.282 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.24 -30.83 51.67 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 118.395 0.543 . . . . 0.0 110.879 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.19 -53.14 53.96 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.549 1.14 . . . . 0.0 110.528 -178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.435 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.26 -35.49 79.63 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.393 -0.822 . . . . 0.0 111.252 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -65.82 -51.74 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 O-C-N 123.433 0.458 . . . . 0.0 110.048 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 11' ' ' LEU . 40.9 ptt180 -68.8 -27.0 65.48 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.041 0.536 . . . . 0.0 110.29 -176.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.6 -48.98 79.36 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 123.96 0.788 . . . . 0.0 109.657 173.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.2 mt -63.15 -47.41 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 124.274 0.984 . . . . 0.0 110.932 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 8' ' ' ARG . 52.2 mt -60.3 -42.79 96.28 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.492 0.717 . . . . 0.0 111.025 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.458 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -77.33 -18.78 77.66 Favored Glycine 0 C--N 1.339 0.72 0 CA-C-N 115.742 -0.663 . . . . 0.0 113.202 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.1 -43.31 43.9 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.225 0.512 . . . . 0.0 109.693 174.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 10' ' ' ILE . 88.1 t -71.8 -60.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -83.05 -3.8 57.65 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.621 -170.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 66.61 55.97 0.76 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.792 1.237 . . . . 0.0 111.733 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -84.11 -29.25 26.91 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.964 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.25 -99.54 1.32 Allowed Glycine 0 C--N 1.35 1.343 0 O-C-N 123.542 0.526 . . . . 0.0 112.52 177.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.15 -23.05 18.09 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.826 0.85 . . . . 0.0 110.389 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.518 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.24 -30.86 71.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 0.0 110.421 -175.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 60.0 pttt -62.8 -33.61 75.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.309 0.644 . . . . 0.0 111.806 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -88.71 -18.54 27.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.024 0.529 . . . . 0.0 111.315 -172.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -94.52 -1.53 53.25 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.049 0.54 . . . . 0.0 111.244 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.518 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -99.0 148.12 24.32 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 173.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.5 p -118.39 -171.95 2.18 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.528 0.731 . . . . 0.0 111.173 -170.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.06 -23.47 67.46 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.114 0.565 . . . . 0.0 112.458 178.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.1 t -88.01 -17.05 32.03 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.328 0.651 . . . . 0.0 111.753 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 24' ' ' LEU . 79.0 p -77.33 128.06 33.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.44 0.296 . . . . 0.0 110.214 -178.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.4 t -81.38 143.04 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 124.571 1.149 . . . . 0.0 109.772 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.569 ' HA ' HG12 ' A' ' 34' ' ' ILE . 64.4 mt -102.33 -67.81 0.86 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.397 0.679 . . . . 0.0 110.236 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.601 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.2 tt -57.46 115.74 2.92 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.88 0.872 . . . . 0.0 111.442 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.59 -22.54 7.5 Favored Glycine 0 C--N 1.353 1.479 0 CA-C-N 115.747 -0.661 . . . . 0.0 114.272 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -90.1 -47.18 7.98 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.709 0.804 . . . . 0.0 110.687 -176.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.569 HG12 ' HA ' ' A' ' 30' ' ' LEU . 43.8 mm -75.63 122.16 86.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.07 -8.55 23.92 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.797 2.331 . . . . 0.0 113.288 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.423 ' H ' HG22 ' A' ' 34' ' ' ILE . 58.7 mm-40 -90.49 -28.85 18.29 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 173.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.601 HD12 ' HA ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -74.53 94.26 2.6 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 32.1 t70 -125.74 -166.21 1.53 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 125.246 1.418 . . . . 0.0 107.705 171.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 42' ' ' VAL . 12.9 m -41.82 -69.39 0.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.605 1.562 . . . . 0.0 114.58 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 mmt -70.74 -23.92 62.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.242 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 45' ' ' VAL . . . -60.71 -41.77 95.88 Favored 'General case' 0 C--N 1.345 0.392 0 O-C-N 123.932 0.77 . . . . 0.0 111.405 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -63.13 -42.38 96.33 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.1 t -63.81 -45.6 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.729 0.776 . . . . 0.0 110.354 -176.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -58.23 -47.96 81.88 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.502 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.458 ' O ' HD23 ' A' ' 49' ' ' LEU . 24.8 m -76.01 -25.29 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 119.069 -0.491 . . . . 0.0 112.017 -175.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 42' ' ' VAL . 90.7 mt -62.74 -55.73 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 171.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.7 m -54.98 -46.91 75.14 Favored 'General case' 0 C--N 1.356 0.888 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.795 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.97 89.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.991 0.917 . . . . 0.0 111.621 -177.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -53.89 -43.55 69.75 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.293 0.637 . . . . 0.0 110.071 175.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.478 ' HG2' ' H ' ' A' ' 57' ' ' VAL . 42.9 mt-10 -61.8 -45.4 94.0 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.309 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' THR . 44.1 mm-40 -63.39 -55.18 26.51 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.177 0.591 . . . . 0.0 111.477 -176.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -69.0 -42.06 76.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.147 0.579 . . . . 0.0 112.439 -174.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -82.65 -11.31 58.46 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 66.43 38.02 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.654 1.182 . . . . 0.0 111.69 174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.3 -168.7 1.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.716 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.5 t -133.51 116.99 16.62 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 167.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.478 ' H ' ' HG2' ' A' ' 50' ' ' GLU . 48.0 t -69.75 113.8 6.17 Favored 'Isoleucine or valine' 0 C--N 1.351 0.636 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 173.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.512 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.0 t70 -70.3 148.85 48.02 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.671 0.789 . . . . 0.0 110.784 -173.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -56.97 -41.49 78.44 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.336 0.654 . . . . 0.0 112.491 -176.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.63 -27.29 67.57 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.51 0.724 . . . . 0.0 112.308 -174.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -95.79 -5.42 41.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.241 0.616 . . . . 0.0 111.129 -177.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 58' ' ' ASP . 58.2 mt -83.67 106.82 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 122.735 0.414 . . . . 0.0 110.02 175.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -128.28 173.98 9.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.035 0.934 . . . . 0.0 109.546 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.91 -31.27 70.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.079 0.552 . . . . 0.0 110.149 169.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -67.11 -18.97 65.55 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.396 175.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.5 m -73.68 -37.28 65.28 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.557 ' HA ' HD21 ' A' ' 73' ' ' LEU . 68.1 m-85 -107.83 15.76 24.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.519 0.728 . . . . 0.0 112.196 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.78 -42.69 94.89 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.371 0.419 . . . . 0.0 110.477 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.0 t -146.85 166.18 27.47 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.034 0.534 . . . . 0.0 110.606 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 24' ' ' LEU . 61.9 tp -62.47 -35.48 79.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.071 0.549 . . . . 0.0 110.681 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.24 -32.14 79.6 Favored Glycine 0 C--N 1.351 1.402 0 O-C-N 123.688 0.618 . . . . 0.0 112.72 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.4 m -68.4 -52.65 30.61 Favored 'General case' 0 C--N 1.347 0.5 0 C-N-CA 123.161 0.585 . . . . 0.0 110.469 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.557 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.1 mm? -61.57 -42.24 98.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 117.812 0.278 . . . . 0.0 111.497 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.547 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.46 -46.74 80.22 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.071 0.857 . . . . 0.0 110.248 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -49.66 76.83 Favored 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 124.208 1.003 . . . . 0.0 110.599 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.47 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 18.1 m-85 -60.07 -50.47 73.59 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.52 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.71 -28.89 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.652 0.381 . . . . 0.0 111.695 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 50.2 mm-40 -60.27 -46.79 88.61 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 170.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.27 -29.4 70.49 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.927 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -70.32 -56.61 6.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.101 0.56 . . . . 0.0 111.908 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.21 -14.02 62.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.547 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 122.259 0.224 . . . . 0.0 110.614 170.759 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . 0.451 HE21 ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -101.3 -37.8 8.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.341 1.056 . . . . 0.0 110.841 176.033 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.442 ' O ' HG23 ' A' ' 7' ' ' VAL . 79.4 m-70 -79.93 -16.5 55.16 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -169.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 2.4 pt? -53.5 -28.67 32.21 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.499 0.59 . . . . 0.0 111.622 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -57.81 -56.54 20.69 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.496 1.518 . . . . 0.0 110.409 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.414 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.41 -28.3 64.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.802 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 3' ' ' HIS . 95.2 t -68.29 -50.6 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.075 0 C-N-CA 122.474 0.31 . . . . 0.0 110.924 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 19.0 ptt85 -70.52 -24.04 62.75 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.415 0.286 . . . . 0.0 110.56 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.14 -48.47 81.46 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.795 170.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 6' ' ' ALA . 81.3 mt -60.48 -57.73 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.936 0.894 . . . . 0.0 111.74 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.46 ' HG ' HG11 ' A' ' 45' ' ' VAL . 9.2 mp -64.31 -34.92 79.25 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 123.083 0.239 . . . . 0.0 110.999 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.567 ' HA3' ' HD2' ' A' ' 21' ' ' LYS . . . -66.51 -34.39 87.55 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-N 116.239 -0.437 . . . . 0.0 113.376 174.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -72.06 -52.05 18.7 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.577 0.751 . . . . 0.0 109.893 -178.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.4 t -66.63 -53.17 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.014 0.926 . . . . 0.0 110.655 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.436 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.6 mm? -87.91 -5.24 58.66 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 65.1 56.02 1.07 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.996 0.903 . . . . 0.0 110.925 174.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.521 HD23 ' HA2' ' A' ' 12' ' ' GLY . 4.3 mm? -70.48 -31.7 68.93 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 178.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 73.89 -98.58 0.98 Allowed Glycine 0 C--N 1.342 0.877 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.334 -178.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.69 -11.74 19.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.953 0.901 . . . . 0.0 111.152 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -72.26 -29.29 63.77 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -178.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HD2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -69.15 -10.76 59.23 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 173.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -89.35 -36.94 15.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.116 0.566 . . . . 0.0 110.722 177.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.2 t -76.88 -21.61 54.69 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.647 0.379 . . . . 0.0 111.217 -173.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -86.99 146.84 25.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.8 p -123.72 -169.47 1.95 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.463 1.105 . . . . 0.0 109.218 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.78 72.87 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.611 0.364 . . . . 0.0 110.786 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.8 m -80.78 2.56 25.71 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.627 0.771 . . . . 0.0 112.44 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -95.29 145.57 24.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.84 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -77.95 156.87 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.303 1.041 . . . . 0.0 109.139 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 70' ' ' LEU . 82.5 mt -119.87 -62.98 1.42 Allowed 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.902 -0.499 . . . . 0.0 110.234 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 37' ' ' LEU . 93.8 mt -55.34 112.3 1.07 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.307 0.643 . . . . 0.0 110.984 172.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.49 -33.48 4.95 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.017 -0.538 . . . . 0.0 113.328 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.43 -41.31 69.66 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.165 0.586 . . . . 0.0 110.174 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.505 HD12 HD11 ' A' ' 17' ' ' LEU . 20.3 mm -90.35 119.22 69.19 Favored Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 174.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.86 -12.28 32.41 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.685 2.256 . . . . 0.0 112.79 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.406 ' H ' HG22 ' A' ' 34' ' ' ILE . 36.4 mm-40 -93.15 -23.87 18.44 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.169 0.588 . . . . 0.0 111.384 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 31' ' ' LEU . 1.2 tm? -79.46 82.32 5.6 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -176.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.475 ' O ' HG13 ' A' ' 42' ' ' VAL . 17.9 t70 -115.68 -155.34 0.57 Allowed 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 125.081 1.352 . . . . 0.0 108.739 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.606 ' O ' HG22 ' A' ' 42' ' ' VAL . 36.0 t -54.26 -71.7 0.07 Allowed 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.078 1.351 . . . . 0.0 113.991 -169.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.67 -24.08 67.64 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.649 -0.657 . . . . 0.0 112.016 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.453 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -67.87 -37.97 82.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.45 0.7 . . . . 0.0 111.678 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 39' ' ' SER . 6.3 m -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 C--N 1.369 1.456 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 174.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 t -70.33 -40.49 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.829 -176.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -63.81 -41.22 97.93 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.233 1.013 . . . . 0.0 112.076 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.46 HG11 ' HG ' ' A' ' 11' ' ' LEU . 21.7 m -74.37 -33.06 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.355 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.454 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.8 mt -59.43 -47.28 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 41.5 m -59.18 -43.48 92.16 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.109 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -32.26 73.54 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.679 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.8 -45.58 91.89 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 2.4 mm-40 -57.39 -49.34 76.5 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.617 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 47' ' ' THR . 17.6 mm-40 -67.02 -52.45 42.24 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.465 0.706 . . . . 0.0 111.995 -174.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.66 -60.66 3.33 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.7 0.8 . . . . 0.0 111.718 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -78.02 -17.77 56.68 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.232 0.332 . . . . 0.0 111.43 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 65.6 62.43 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.768 1.227 . . . . 0.0 109.82 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.38 -166.61 2.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.656 176.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.5 m -133.01 113.09 12.4 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 123.204 0.602 . . . . 0.0 109.974 167.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 70.7 t -73.17 108.84 4.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.713 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 167.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 22.9 t70 -63.08 148.91 46.48 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.509 -171.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.3 -32.09 71.94 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.895 0.478 . . . . 0.0 112.0 -175.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -70.19 -27.92 64.89 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.535 0.734 . . . . 0.0 111.533 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.1 pt-20 -92.68 -12.48 31.39 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.183 0.193 . . . . 0.0 110.973 -178.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 58' ' ' ASP . 45.5 mt -84.91 106.94 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 122.92 0.488 . . . . 0.0 110.149 175.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.2 p -130.0 179.68 5.73 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.361 1.064 . . . . 0.0 108.703 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.37 -34.5 78.31 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.014 174.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -67.92 -12.71 61.23 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.314 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -70.65 -40.09 73.25 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.829 0.451 . . . . 0.0 110.603 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.505 ' HA ' HD21 ' A' ' 73' ' ' LEU . 52.5 m-85 -107.61 18.26 21.66 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 69' ' ' THR . 11.1 pt-20 -61.73 -38.35 87.58 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 72' ' ' SER . 8.3 t -146.24 160.6 41.77 Favored 'General case' 0 C--O 1.25 1.103 0 C-N-CA 123.315 0.646 . . . . 0.0 110.729 175.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.41 ' HA ' HD11 ' A' ' 30' ' ' LEU . 12.5 tp -63.6 -29.62 70.84 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.67 -38.22 95.37 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.992 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.509 ' H ' HG23 ' A' ' 69' ' ' THR . 64.4 m -58.67 -51.53 69.52 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -58.37 -45.48 88.19 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 123.667 0.605 . . . . 0.0 111.194 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.592 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -55.45 -45.45 76.86 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.708 1.255 . . . . 0.0 110.143 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.47 -43.57 85.09 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.724 0.64 . . . . 0.0 111.548 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 21.3 m-85 -54.32 -55.78 25.04 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.5 m -73.39 -24.79 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.148 0.979 . . . . 0.0 112.301 -174.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.0 mm-40 -55.64 -54.95 37.88 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 168.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -69.08 -32.08 71.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.765 -171.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.71 -54.96 41.0 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.23 0.612 . . . . 0.0 110.721 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.401 HD22 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -80.73 -13.55 58.89 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.777 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.478 0.929 0 C-N-CA 122.362 0.265 . . . . 0.0 110.413 170.957 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -94.51 -53.96 3.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 122.05 0.929 . . . . 0.0 108.741 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 7' ' ' VAL . 97.6 m-70 -70.8 -17.71 62.76 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.0 -1.909 . . . . 0.0 113.419 -164.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -50.09 -34.35 21.55 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -72.3 -42.37 65.55 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 122.511 0.324 . . . . 0.0 110.617 -176.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.83 -33.88 76.87 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.214 0.605 . . . . 0.0 111.07 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 3' ' ' HIS . 83.9 t -66.66 -50.79 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.153 0.581 . . . . 0.0 109.767 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.9 ptt180 -68.6 -26.83 65.57 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.711 0.404 . . . . 0.0 110.634 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.404 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 32.0 t30 -61.64 -50.01 74.24 Favored 'General case' 0 C--O 1.25 1.09 0 C-N-CA 123.996 0.919 . . . . 0.0 109.758 175.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.19 -50.06 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.719 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.3 mt -58.86 -39.89 82.7 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.433 0.693 . . . . 0.0 111.475 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.452 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -71.98 -28.08 69.29 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-O 119.851 -0.416 . . . . 0.0 113.337 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -75.41 -39.51 58.88 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 117.031 0.415 . . . . 0.0 110.686 175.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.2 t -75.18 -54.29 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.005 0.522 . . . . 0.0 110.493 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.542 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.4 mm? -84.78 1.44 46.7 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.172 0.589 . . . . 0.0 112.072 -176.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 65.82 46.61 2.26 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 122.22 1.009 . . . . 0.0 111.245 170.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 mp -77.52 -34.95 53.88 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.873 172.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.49 -91.24 0.25 Allowed Glycine 0 C--N 1.352 1.455 0 O-C-N 123.912 0.757 . . . . 0.0 113.072 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -92.5 -28.92 16.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.984 0.914 . . . . 0.0 110.657 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.2 OUTLIER -65.54 -24.64 67.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.692 0.797 . . . . 0.0 111.435 -173.492 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.452 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 61.0 pttt -65.18 -27.03 68.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.847 0.459 . . . . 0.0 111.817 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.8 t-80 -92.01 -22.96 19.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.774 0.43 . . . . 0.0 110.877 -175.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.473 HG22 ' HA ' ' A' ' 20' ' ' ARG . 7.2 t -86.15 -1.05 57.06 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.359 0.264 . . . . 0.0 111.187 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -103.64 156.43 17.8 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.956 0.408 . . . . 0.0 110.146 172.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.3 p -121.51 -172.34 2.4 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.216 1.006 . . . . 0.0 110.178 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.3 81.23 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 t -75.18 -3.73 34.7 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.002 0.521 . . . . 0.0 112.194 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.1 t -67.68 137.1 55.29 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.001 0.521 . . . . 0.0 110.498 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -86.7 150.69 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.918 0.887 . . . . 0.0 109.863 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.3 mt -109.02 -66.93 1.01 Allowed 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.5 mt -54.41 121.39 8.21 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.842 0.857 . . . . 0.0 111.264 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.76 -28.56 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 119.533 -0.593 . . . . 0.0 113.809 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -77.71 -66.21 0.87 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.498 0.649 . . . . 0.0 110.021 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.16 119.27 76.81 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.192 -175.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.99 -15.52 36.26 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 122.315 2.01 . . . . 0.0 111.899 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -88.04 -29.26 20.81 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.944 0.898 . . . . 0.0 110.152 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.8 100.57 3.48 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.441 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 27.1 t70 -132.52 -156.83 0.78 Allowed 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 171.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.716 ' O ' HG22 ' A' ' 42' ' ' VAL . 58.0 p -67.46 -54.52 19.5 Favored 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -167.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 97.0 mmm -61.55 -27.52 68.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.691 -1.255 . . . . 0.0 111.263 177.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.542 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -68.24 -33.73 74.93 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.795 175.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.716 HG22 ' O ' ' A' ' 39' ' ' SER . 5.9 m -64.68 -37.62 80.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 118.791 0.723 . . . . 0.0 109.645 175.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.49 -48.15 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 121.499 0.666 . . . . 0.0 109.956 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -60.41 -45.84 92.15 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 113.799 -1.546 . . . . 0.0 112.634 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' HD23 ' A' ' 49' ' ' LEU . 32.6 m -71.05 -31.94 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 119.031 -0.509 . . . . 0.0 111.575 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.424 HD13 HD13 ' A' ' 62' ' ' ILE . 82.3 mt -63.48 -50.57 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -50.91 -48.76 60.52 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.508 1.13 . . . . 0.0 110.922 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.44 -46.82 84.5 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.798 -178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.3 mm? -55.2 -45.23 75.86 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.576 0.75 . . . . 0.0 110.366 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.5 -40.1 96.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.823 0.849 . . . . 0.0 112.05 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -65.48 -52.52 52.27 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.43 0.692 . . . . 0.0 112.139 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.49 -49.48 40.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -176.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -75.45 -16.76 60.3 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.834 0.454 . . . . 0.0 111.755 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.49 46.76 3.2 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.432 1.11 . . . . 0.0 110.273 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.93 -170.78 2.58 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.483 175.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.9 t -126.08 117.14 22.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 166.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.12 108.54 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.76 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.592 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.2 t70 -72.8 144.23 47.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.463 0.705 . . . . 0.0 111.286 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.55 -38.7 64.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.875 0.87 . . . . 0.0 112.626 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -71.6 -21.19 61.89 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.218 0.607 . . . . 0.0 111.99 -172.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 10.8 pt-20 -94.6 -17.39 22.36 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.424 HD13 HD13 ' A' ' 46' ' ' ILE . 76.7 mt -81.05 109.39 15.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 123.185 0.594 . . . . 0.0 110.078 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.3 t -130.11 170.4 14.08 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 164.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.91 76.06 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -63.95 -18.97 64.78 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.498 0.719 . . . . 0.0 112.243 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.6 m -64.47 -38.81 92.3 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.283 0.633 . . . . 0.0 110.097 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.571 ' HA ' HD21 ' A' ' 73' ' ' LEU . 77.3 m-85 -96.17 19.45 11.77 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.34 1.056 . . . . 0.0 112.623 -177.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.64 -48.9 77.36 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 123.091 0.244 . . . . 0.0 110.447 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.6 p -142.05 162.59 35.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.816 0.847 . . . . 0.0 110.395 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 60.9 tp -56.29 -40.32 74.12 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.017 0.927 . . . . 0.0 111.386 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.74 -35.45 92.03 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 114.513 -1.222 . . . . 0.0 112.034 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 m -62.2 -51.03 69.43 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 122.959 0.504 . . . . 0.0 110.483 177.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.571 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.07 -42.56 80.84 Favored 'General case' 0 C--N 1.365 1.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.887 176.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.571 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.74 -43.25 85.24 Favored 'General case' 0 C--O 1.21 -1.018 0 O-C-N 124.686 1.241 . . . . 0.0 110.973 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.87 -51.47 68.07 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.864 0.727 . . . . 0.0 110.791 178.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.529 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 68.5 m-85 -55.69 -49.7 72.25 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 123.668 0.605 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.2 m -72.64 -24.86 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.163 0.585 . . . . 0.0 112.018 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.5 mm-40 -56.82 -53.73 54.53 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 169.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -58.69 -43.24 89.93 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.487 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -53.52 -59.02 5.13 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 124.118 0.886 . . . . 0.0 112.157 -177.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -79.22 -13.89 59.41 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.121 -174.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.2 m . . . . . 0 N--CA 1.477 0.908 0 C-N-CA 122.751 0.42 . . . . 0.0 111.478 174.86 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -36.71 -47.36 0.66 Allowed 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 115.903 1.816 . . . . 0.0 115.903 -162.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.412 ' O ' HG23 ' A' ' 7' ' ' VAL . 39.1 m-70 -68.48 -25.98 65.25 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.47 -30.78 8.69 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 123.925 0.89 . . . . 0.0 112.776 -179.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.86 -50.58 66.05 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 124.315 1.046 . . . . 0.0 110.797 -176.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.22 -25.7 55.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.882 -179.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 3' ' ' HIS . 70.5 t -67.29 -49.59 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -71.55 -24.46 61.94 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.096 0.558 . . . . 0.0 110.3 -178.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -60.95 -50.26 74.12 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.252 0.621 . . . . 0.0 109.666 171.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.35 -46.86 95.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.481 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.2 mt -62.71 -42.51 99.68 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.01 0.524 . . . . 0.0 110.494 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.586 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -68.17 -22.15 74.23 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.436 -0.802 . . . . 0.0 113.239 178.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -84.3 -47.44 10.75 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.372 0.669 . . . . 0.0 111.504 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.16 -58.24 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.455 0.702 . . . . 0.0 110.447 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.5 mm? -80.76 -14.02 58.46 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.792 0.437 . . . . 0.0 110.605 -175.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 67.16 64.47 0.44 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.338 1.055 . . . . 0.0 109.714 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.492 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 3.6 mm? -79.33 -27.04 42.07 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.386 -0.825 . . . . 0.0 108.904 164.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 64.43 -100.82 0.45 Allowed Glycine 0 C--N 1.354 1.55 0 O-C-N 123.664 0.602 . . . . 0.0 113.636 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -89.09 -23.63 22.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.955 0.902 . . . . 0.0 110.795 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' HD12 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -70.81 -22.6 62.33 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.573 0.749 . . . . 0.0 111.003 -176.41 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 22.8 pttm -63.99 -23.6 67.4 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.138 -0.351 . . . . 0.0 110.927 173.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -80.69 -23.83 39.3 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.364 0.666 . . . . 0.0 111.485 -178.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.4 t -94.43 -15.72 24.03 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -91.27 149.48 21.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 81.4 p -118.4 -169.89 1.79 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.361 1.064 . . . . 0.0 109.36 -177.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.17 63.8 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 122.927 0.491 . . . . 0.0 112.195 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -74.16 -16.53 60.99 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.978 0.911 . . . . 0.0 112.452 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.6 p -66.51 123.11 19.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.03 0.532 . . . . 0.0 111.043 -176.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.5 t -75.98 148.67 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 175.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.411 ' HA ' HG12 ' A' ' 34' ' ' ILE . 74.5 mt -113.83 -67.65 0.98 Allowed 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.076 -0.39 . . . . 0.0 110.145 -178.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.89 111.37 1.14 Allowed 'General case' 0 C--N 1.35 0.625 0 C-N-CA 122.98 0.512 . . . . 0.0 110.926 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 -34.62 4.98 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-N 115.216 -0.902 . . . . 0.0 113.191 178.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -80.76 -45.57 16.82 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.266 0.626 . . . . 0.0 110.856 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 30' ' ' LEU . 23.4 mm -90.67 116.15 65.77 Favored Pre-proline 0 C--O 1.243 0.734 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 177.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.15 -4.86 14.71 Favored 'Trans proline' 0 C--N 1.368 1.583 0 C-N-CA 122.446 2.097 . . . . 0.0 112.401 -177.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 14.4 mm-40 -89.26 -18.42 27.05 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.397 0.679 . . . . 0.0 110.151 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 56.9 tp -83.63 87.64 7.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.597 0.713 . . . . 0.0 109.189 -177.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.407 ' N ' ' HB3' ' A' ' 41' ' ' ALA . 29.6 t70 -85.53 173.14 10.42 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.94 1.296 . . . . 0.0 110.287 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.665 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.9 t -49.32 -65.21 0.61 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 125.337 1.455 . . . . 0.0 112.231 169.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.0 mmt -60.88 -23.76 65.44 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.306 -0.871 . . . . 0.0 111.981 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.407 ' HB3' ' N ' ' A' ' 38' ' ' ASP . . . -73.14 -28.39 62.22 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.665 HG22 ' O ' ' A' ' 39' ' ' SER . 4.3 m -66.16 -37.53 79.95 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -67.0 -39.45 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.85 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -59.66 -47.4 85.76 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.756 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.48 -30.46 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.753 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.5 HD13 HD13 ' A' ' 62' ' ' ILE . 97.0 mt -64.5 -48.19 86.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.7 m -58.74 -44.71 90.57 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.267 0.979 . . . . 0.0 110.532 177.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.97 89.35 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.129 178.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -58.2 -45.77 87.0 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.146 0.578 . . . . 0.0 109.635 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.5 mm-40 -51.5 -49.25 62.24 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 124.325 1.015 . . . . 0.0 110.037 175.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 47' ' ' THR . 25.4 mm-40 -62.1 -66.32 0.56 Allowed 'General case' 0 C--N 1.353 0.727 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.695 -173.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -70.6 -37.14 73.85 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -168.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -88.33 -14.84 37.21 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.325 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 63.79 46.12 4.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.28 1.032 . . . . 0.0 111.548 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.515 ' CZ ' HG22 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -141.52 -171.94 3.42 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.316 -179.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 t -126.0 130.91 52.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 122.918 0.487 . . . . 0.0 110.149 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.515 HG22 ' CZ ' ' A' ' 55' ' ' PHE . 2.6 t -86.31 118.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 172.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 27.0 t70 -76.08 144.8 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.4 0.68 . . . . 0.0 111.838 -170.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -55.22 -40.06 70.4 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.131 0.973 . . . . 0.0 113.377 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.34 -32.32 68.41 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.276 0.631 . . . . 0.0 112.068 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.4 pt-20 -85.96 -23.62 26.85 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.5 HD13 HD13 ' A' ' 46' ' ' ILE . 68.9 mt -72.25 110.12 5.05 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t -139.76 175.82 9.25 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 171.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.9 71.61 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -63.97 -21.4 66.47 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.143 0.977 . . . . 0.0 112.26 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.451 HG22 HD13 ' A' ' 73' ' ' LEU . 20.7 m -81.97 -41.13 21.21 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.189 0.595 . . . . 0.0 110.17 175.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.508 ' HA ' HD21 ' A' ' 73' ' ' LEU . 61.9 m-85 -101.02 7.25 43.57 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.573 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -62.33 -41.24 98.39 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.948 0.499 . . . . 0.0 111.426 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.573 HG22 ' HG3' ' A' ' 68' ' ' GLU . 7.1 t -148.6 154.76 40.17 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.518 0.727 . . . . 0.0 110.052 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.2 tp -56.21 -33.02 64.94 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.201 1.0 . . . . 0.0 111.604 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.18 -43.25 99.64 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.531 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -61.88 -44.14 97.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.968 0.507 . . . . 0.0 111.05 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.5 mm? -59.01 -47.57 84.71 Favored 'General case' 0 C--N 1.363 1.166 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.612 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -53.41 -52.86 58.01 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 124.624 1.203 . . . . 0.0 110.031 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.1 -45.15 93.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.11 0.964 . . . . 0.0 112.224 -174.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.462 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.7 m-85 -60.44 -49.89 75.77 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.256 0.222 . . . . 0.0 110.867 177.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.2 m -71.39 -23.84 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 122.521 0.329 . . . . 0.0 111.132 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 81.8 mm-40 -56.86 -50.48 72.33 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -57.79 -47.96 81.07 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.108 0.88 . . . . 0.0 110.733 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.6 mmmt -62.7 -55.01 30.71 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.209 -172.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.69 -12.24 60.95 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.511 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 CA--C 1.551 1.019 0 C-N-CA 123.057 0.543 . . . . 0.0 111.49 171.292 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mpp? . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.767 0.318 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -92.25 -45.59 8.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.289 1.042 . . . . 0.0 108.216 176.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -79.48 -9.84 59.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 113.498 -1.683 . . . . 0.0 113.597 -164.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -53.13 -30.27 35.86 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.632 0.651 . . . . 0.0 112.341 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.68 -51.67 61.26 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.048 0.939 . . . . 0.0 110.793 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.56 -35.55 75.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.429 -177.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.2 t -63.91 -50.34 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 122.923 0.489 . . . . 0.0 109.814 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -67.88 -28.65 67.7 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.773 0.429 . . . . 0.0 110.461 -177.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -61.89 -48.77 79.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.656 0.782 . . . . 0.0 109.881 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.5 mt -59.13 -55.24 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.191 0.996 . . . . 0.0 110.995 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.37 -45.2 88.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.116 -174.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.48 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.37 -19.48 79.83 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 116.265 -0.425 . . . . 0.0 113.536 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.8 -38.33 58.29 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.983 0.391 . . . . 0.0 110.104 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -75.29 -56.43 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.529 0.732 . . . . 0.0 110.37 -178.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.431 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.4 mm? -81.75 2.19 31.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.513 0.725 . . . . 0.0 112.031 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.6 34.49 2.72 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.434 1.093 . . . . 0.0 111.897 168.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HG ' ' HD2' ' A' ' 20' ' ' ARG . 6.0 mp -68.12 -33.71 75.01 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.872 0.869 . . . . 0.0 111.256 177.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.26 -95.13 0.57 Allowed Glycine 0 C--N 1.351 1.411 0 O-C-N 123.463 0.477 . . . . 0.0 113.095 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -96.33 -24.7 16.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.0 0.92 . . . . 0.0 110.434 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.1 OUTLIER -61.68 -28.74 69.61 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.424 0.69 . . . . 0.0 111.423 -176.103 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.2 pttt -65.98 -26.25 67.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.376 0.67 . . . . 0.0 112.224 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -96.73 -20.93 17.88 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.272 0.629 . . . . 0.0 110.998 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.526 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.1 t -87.2 4.96 40.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.769 0.427 . . . . 0.0 111.38 179.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -107.69 169.87 8.33 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.376 0.67 . . . . 0.0 109.684 171.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.5 p -127.18 -171.38 2.4 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 0.0 109.56 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.74 -31.54 70.86 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.907 0.483 . . . . 0.0 112.016 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -73.4 -4.93 36.58 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -71.6 129.74 39.46 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.03 0.532 . . . . 0.0 110.835 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.405 ' HB ' ' HB2' ' A' ' 33' ' ' ASN . 59.2 t -73.63 155.33 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 124.409 1.083 . . . . 0.0 108.72 171.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 27.3 mt -124.59 -67.13 0.93 Allowed 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 68' ' ' GLU . 5.2 tt -64.96 110.86 2.6 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 172.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.98 -32.13 7.83 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 123.477 0.486 . . . . 0.0 112.73 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.405 ' HB2' ' HB ' ' A' ' 29' ' ' VAL . 53.7 t-20 -84.31 -65.41 1.01 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.78 0.832 . . . . 0.0 110.434 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.424 HG22 ' H ' ' A' ' 36' ' ' GLU . 27.4 mm -71.86 118.12 63.96 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.527 -171.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.92 -4.13 14.85 Favored 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 122.559 2.173 . . . . 0.0 112.442 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 37.7 mm-40 -99.32 -10.24 22.56 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.318 1.047 . . . . 0.0 111.045 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -78.29 82.95 4.56 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.463 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 25.3 t70 -91.85 169.63 10.53 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.587 1.555 . . . . 0.0 110.439 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.573 ' O ' HG22 ' A' ' 42' ' ' VAL . 45.9 t -44.25 -65.73 0.48 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 126.508 1.923 . . . . 0.0 112.637 170.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.4 mmm -68.03 -21.73 65.0 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.896 -0.503 . . . . 0.0 111.522 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.463 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -74.49 -23.87 58.93 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 118.273 -0.87 . . . . 0.0 112.053 174.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' SER . 2.9 m -67.96 -39.55 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 171.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 t -63.35 -44.46 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.162 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.06 -44.37 96.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.306 -1.316 . . . . 0.0 112.887 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -74.2 -30.37 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-O 119.318 -0.373 . . . . 0.0 111.595 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.519 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -61.56 -55.86 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.46 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.9 m -56.12 -39.83 72.82 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 124.629 1.206 . . . . 0.0 111.369 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.403 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -64.69 -46.01 84.19 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.767 0.827 . . . . 0.0 111.69 178.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.403 HD22 HG21 ' A' ' 10' ' ' ILE . 3.5 mm? -54.96 -44.8 74.7 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.328 0.651 . . . . 0.0 110.244 174.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 10.2 mm-40 -53.72 -50.02 66.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.524 1.129 . . . . 0.0 111.447 176.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.6 mm-40 -64.84 -55.8 17.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.542 0.737 . . . . 0.0 111.954 -174.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.403 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 56.5 m-85 -62.6 -56.02 21.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.365 0.666 . . . . 0.0 111.954 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.39 -9.74 59.66 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.2 t70 67.15 35.4 4.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 124.502 1.121 . . . . 0.0 111.106 169.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -173.6 3.44 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.262 0.625 . . . . 0.0 110.772 -171.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.4 m -128.9 113.43 15.22 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.382 0.673 . . . . 0.0 111.362 172.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.74 118.3 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 164.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.591 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 20.7 t70 -72.28 145.88 47.57 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.175 0.443 . . . . 0.0 109.98 -174.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.46 -25.98 67.75 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 121.706 -0.621 . . . . 0.0 112.468 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -76.44 -7.2 54.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.952 0.501 . . . . 0.0 112.071 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.9 pt-20 -111.29 -20.25 12.36 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.825 0.45 . . . . 0.0 110.575 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 58' ' ' ASP . 56.3 mt -77.69 114.58 18.38 Favored 'Isoleucine or valine' 0 C--N 1.357 0.928 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 175.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.6 p -131.75 177.22 7.69 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.676 1.191 . . . . 0.0 108.127 168.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.04 73.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.676 0.75 . . . . 0.0 109.756 171.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -69.79 -11.37 60.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.261 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -80.14 -40.46 27.34 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 122.797 0.439 . . . . 0.0 110.023 173.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.676 ' HA ' HD21 ' A' ' 73' ' ' LEU . 37.7 m-85 -99.31 14.03 31.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.548 0.339 . . . . 0.0 111.775 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 11.4 pt-20 -60.95 -40.39 93.11 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 123.786 0.679 . . . . 0.0 112.0 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.2 m -151.82 150.11 29.76 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.096 0.958 . . . . 0.0 109.796 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 tp -53.54 -42.75 67.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.125 0.97 . . . . 0.0 111.861 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.78 -38.23 91.7 Favored Glycine 0 C--N 1.341 0.822 0 O-C-N 124.534 1.146 . . . . 0.0 112.251 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m -58.79 -53.52 57.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.217 0.607 . . . . 0.0 110.268 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.676 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.26 -39.01 91.48 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.385 0.274 . . . . 0.0 110.816 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.611 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.8 -46.23 91.32 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 124.493 1.121 . . . . 0.0 110.334 -177.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -65.07 -44.39 89.11 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.885 0.741 . . . . 0.0 110.883 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.474 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 15.9 m-85 -56.61 -46.9 80.65 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.73 0.412 . . . . 0.0 111.06 179.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.8 m -75.3 -24.63 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 122.832 0.453 . . . . 0.0 111.596 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.5 mm-40 -57.53 -43.58 84.47 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 169.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -67.07 -55.88 12.41 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.211 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -63.82 -54.21 38.63 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.698 0.799 . . . . 0.0 112.235 -168.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.82 -17.63 63.4 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 N--CA 1.48 1.041 0 C-N-CA 122.655 0.382 . . . . 0.0 111.191 177.465 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.695 0.283 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.02 -50.98 3.99 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.58 0.752 . . . . 0.0 111.074 172.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -82.09 0.31 41.2 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.664 -171.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -55.38 -34.76 64.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 123.53 0.519 . . . . 0.0 111.771 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -68.52 -45.01 73.36 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.834 0.709 . . . . 0.0 110.593 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.79 -33.73 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.096 0.559 . . . . 0.0 111.03 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.5 t -66.84 -49.95 69.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 122.872 0.469 . . . . 0.0 109.772 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HG3' ' NZ ' ' A' ' 21' ' ' LYS . 36.3 ptt180 -70.8 -22.18 62.39 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.172 0.589 . . . . 0.0 110.877 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -65.05 -52.89 53.25 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.58 0.752 . . . . 0.0 109.57 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.64 -44.62 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.948 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 65.2 mt -63.38 -44.12 95.65 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.697 0.76 . . . . 0.0 110.277 175.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.557 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -66.72 -19.18 69.06 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 114.665 -1.152 . . . . 0.0 113.582 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -90.83 -52.73 4.72 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.243 0.617 . . . . 0.0 110.788 176.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 84.7 t -68.42 -47.24 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.981 0.912 . . . . 0.0 110.815 -173.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.654 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -83.75 -14.29 51.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.768 0.427 . . . . 0.0 110.791 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 63.26 62.72 0.96 Allowed 'General case' 0 C--N 1.355 0.825 0 C-N-CA 124.446 1.099 . . . . 0.0 110.286 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.557 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 10.0 mp -72.88 -34.34 66.64 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 114.915 -1.038 . . . . 0.0 109.2 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.35 -94.61 0.27 Allowed Glycine 0 C--N 1.353 1.492 0 O-C-N 123.908 0.755 . . . . 0.0 112.418 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -92.95 -18.49 22.67 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.521 0.728 . . . . 0.0 110.614 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.457 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.4 -31.43 72.53 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.731 0.412 . . . . 0.0 110.19 -178.381 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.403 ' NZ ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -70.0 -26.23 63.97 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.763 0.425 . . . . 0.0 111.823 174.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -70.58 -48.4 55.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 20' ' ' ARG . 8.2 t -77.42 -7.21 55.79 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.784 -167.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.644 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 3.9 pp -103.22 157.2 17.17 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.679 0.392 . . . . 0.0 111.179 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 76.2 p -114.57 -169.54 1.56 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.327 1.051 . . . . 0.0 109.472 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.0 69.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.146 0.578 . . . . 0.0 111.35 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -69.54 -12.74 61.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.843 0.857 . . . . 0.0 112.847 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.644 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 46.0 t -59.21 134.56 57.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.972 0.909 . . . . 0.0 111.856 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -83.71 146.15 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.512 ' HA ' HG12 ' A' ' 34' ' ' ILE . 66.7 mt -114.27 -72.65 0.69 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.908 0.483 . . . . 0.0 110.642 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.35 113.36 2.87 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.23 -31.42 8.72 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-N 115.753 -0.658 . . . . 0.0 113.053 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -87.81 -57.61 2.88 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.838 0.455 . . . . 0.0 110.583 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.512 HG12 ' HA ' ' A' ' 30' ' ' LEU . 17.6 mm -71.74 119.82 76.44 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.45 -16.86 30.75 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.279 1.986 . . . . 0.0 111.807 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.435 ' H ' HG22 ' A' ' 34' ' ' ILE . 33.4 mm-40 -86.88 -21.33 26.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.491 0.717 . . . . 0.0 110.902 -177.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -74.39 86.1 2.0 Allowed 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -98.8 173.73 6.73 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.282 1.433 . . . . 0.0 109.731 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.589 ' O ' HG22 ' A' ' 42' ' ' VAL . 1.4 m -46.13 -64.52 0.73 Allowed 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 125.154 1.382 . . . . 0.0 113.22 169.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.7 mmt -63.71 -27.48 69.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 121.189 0.519 . . . . 0.0 110.928 -176.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -64.95 -35.96 82.84 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.583 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 39' ' ' SER . 3.7 m -66.47 -36.04 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-N 118.469 0.577 . . . . 0.0 109.644 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.0 t -64.85 -47.37 88.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 CA-C-O 121.391 0.615 . . . . 0.0 109.9 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -58.72 -46.09 88.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.185 -1.371 . . . . 0.0 112.954 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.1 -33.45 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.977 -0.535 . . . . 0.0 111.722 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 78.8 mt -62.79 -51.55 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 67.6 m -52.25 -44.52 64.93 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.639 1.212 . . . . 0.0 110.95 177.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.67 -48.89 79.78 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.755 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.5 -46.05 66.48 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.684 0.794 . . . . 0.0 110.592 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 5.8 mm-40 -56.34 -47.86 77.92 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.462 1.105 . . . . 0.0 111.05 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 47' ' ' THR . 24.0 mm-40 -65.28 -52.24 55.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.662 0.785 . . . . 0.0 111.736 -176.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -71.2 -38.25 72.06 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.8 -171.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -94.02 -8.08 40.91 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.776 0.43 . . . . 0.0 111.893 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 67.36 28.23 7.91 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.594 1.158 . . . . 0.0 111.963 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -126.17 -177.67 4.04 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.219 0.608 . . . . 0.0 111.09 -171.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.5 m -127.14 121.1 30.45 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.81 0.844 . . . . 0.0 110.959 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.43 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 10.8 t -74.66 134.4 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.555 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.2 t70 -76.18 137.72 40.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.869 0.467 . . . . 0.0 109.911 -176.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.28 -39.05 81.71 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.345 0.658 . . . . 0.0 112.104 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.13 -4.51 41.96 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.542 0.737 . . . . 0.0 112.746 -172.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -100.97 -31.76 10.96 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 58' ' ' ASP . 35.4 mt -70.43 111.96 4.8 Favored 'Isoleucine or valine' 0 C--N 1.354 0.781 0 CA-C-O 121.261 0.553 . . . . 0.0 110.568 -176.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 42.2 t -112.27 171.96 7.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.65 1.18 . . . . 0.0 108.414 169.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.1 -30.05 68.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 167.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -71.98 -10.37 59.68 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.055 0.942 . . . . 0.0 111.542 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.429 HG22 HD13 ' A' ' 73' ' ' LEU . 96.3 m -69.25 -33.16 72.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.596 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.8 m-85 -89.36 11.49 18.96 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 69' ' ' THR . 9.8 pt-20 -58.76 -47.42 84.74 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 118.084 0.402 . . . . 0.0 110.792 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' GLU . 62.7 p -140.18 162.63 34.79 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.508 0.723 . . . . 0.0 111.125 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.71 -42.46 93.1 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 124.056 0.943 . . . . 0.0 110.924 176.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.99 -27.4 70.33 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 124.476 1.11 . . . . 0.0 112.616 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.7 m -67.67 -52.46 37.69 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 122.729 0.412 . . . . 0.0 110.754 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -60.81 -38.24 84.72 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 117.788 0.267 . . . . 0.0 110.769 176.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.01 63.11 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 124.344 1.027 . . . . 0.0 110.049 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.25 -44.91 92.36 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 123.967 0.792 . . . . 0.0 110.483 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.513 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 6.5 m-85 -58.62 -55.83 30.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.207 0.603 . . . . 0.0 111.512 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.8 m -66.67 -27.36 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.412 0.285 . . . . 0.0 111.39 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.57 -28.26 63.72 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.051 0.54 . . . . 0.0 111.036 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 63.2 m170 -73.45 -38.16 65.57 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.753 0.421 . . . . 0.0 110.169 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -69.54 -54.07 15.93 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.887 0.875 . . . . 0.0 112.238 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.68 -14.47 60.35 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.958 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 51.5 m . . . . . 0 N--CA 1.482 1.161 0 CA-C-N 118.078 0.399 . . . . 0.0 110.559 174.186 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -36.91 9.98 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.356 0.662 . . . . 0.0 110.869 177.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -77.89 -14.2 59.63 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-O 118.541 -0.742 . . . . 0.0 112.948 -167.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -51.89 -34.0 39.32 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 123.439 0.695 . . . . 0.0 112.068 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.49 -49.83 69.83 Favored 'General case' 0 C--N 1.352 0.715 0 C-N-CA 124.196 0.998 . . . . 0.0 110.671 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.64 -25.2 60.17 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.501 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.3 t -69.15 -48.83 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.634 0.373 . . . . 0.0 110.051 176.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 38.9 ptt180 -69.82 -25.58 63.83 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.52 0.328 . . . . 0.0 110.305 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -65.19 -47.42 77.01 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 123.577 0.548 . . . . 0.0 109.625 173.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 49' ' ' LEU . 75.3 mt -61.22 -57.75 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.75 0.82 . . . . 0.0 111.428 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.546 HD22 HD13 ' A' ' 30' ' ' LEU . 9.9 mp -66.26 -29.61 69.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.626 0.37 . . . . 0.0 110.59 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.474 ' HA2' HD23 ' A' ' 17' ' ' LEU . . . -66.7 -29.07 74.15 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 119.912 -0.382 . . . . 0.0 113.003 172.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.18 -48.63 17.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.44 0.696 . . . . 0.0 110.557 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 10' ' ' ILE . 59.6 t -66.58 -56.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.526 0.731 . . . . 0.0 110.293 -174.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.546 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -84.54 -2.37 57.24 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.95 0.5 . . . . 0.0 110.982 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 58.0 t30 60.77 50.88 5.13 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.636 1.174 . . . . 0.0 111.533 170.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.496 HD11 HG23 ' A' ' 34' ' ' ILE . 2.7 mm? -72.69 -34.05 66.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.943 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.67 -90.7 0.25 Allowed Glycine 0 C--N 1.348 1.223 0 O-C-N 123.486 0.491 . . . . 0.0 112.772 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -94.01 -23.16 18.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.622 0.769 . . . . 0.0 111.012 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.0 OUTLIER -68.32 -29.13 67.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.458 ' O ' ' HD2' ' A' ' 8' ' ' ARG . 9.5 pttm -69.89 -29.89 67.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.453 0.301 . . . . 0.0 111.017 173.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -75.52 -35.49 60.73 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.181 0.592 . . . . 0.0 110.775 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.2 t -83.49 -22.33 32.55 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.938 0.495 . . . . 0.0 111.67 -174.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -82.45 143.77 30.92 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.4 p -118.98 -174.47 2.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.765 1.226 . . . . 0.0 110.225 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.41 88.8 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.292 0.567 . . . . 0.0 111.213 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 m -84.57 3.85 34.84 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.859 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.0 t -95.31 151.31 19.37 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.676 0.79 . . . . 0.0 110.16 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -87.14 148.79 4.38 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.162 1.385 . . . . 0.0 110.183 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.546 HD13 HD22 ' A' ' 11' ' ' LEU . 70.3 mt -114.72 -68.46 0.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.278 0.631 . . . . 0.0 109.737 175.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.66 112.54 2.29 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.518 0.727 . . . . 0.0 109.256 176.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.37 -40.38 2.5 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 123.615 0.572 . . . . 0.0 112.292 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -83.12 -34.64 26.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.382 0.673 . . . . 0.0 110.835 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.496 HG23 HD11 ' A' ' 17' ' ' LEU . 34.7 mm -87.97 117.16 68.13 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 173.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.27 0.27 10.16 Favored 'Trans proline' 0 C--N 1.369 1.623 0 C-N-CA 122.711 2.274 . . . . 0.0 112.562 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.47 ' H ' HG22 ' A' ' 34' ' ' ILE . 10.9 mm-40 -95.08 -18.03 21.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.909 0.884 . . . . 0.0 109.947 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -81.45 92.54 6.47 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -107.12 -164.75 1.01 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.192 0.997 . . . . 0.0 111.068 176.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.581 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.0 t -49.6 -69.3 0.12 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.294 1.838 . . . . 0.0 112.953 176.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.8 mmm -68.84 -19.06 64.25 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.895 -0.503 . . . . 0.0 111.233 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -65.82 -43.3 89.0 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-O 118.706 -0.664 . . . . 0.0 111.538 174.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 39' ' ' SER . 4.5 m -61.43 -38.22 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 t -66.38 -47.33 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.964 -176.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -61.51 -40.47 94.72 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.017 -1.447 . . . . 0.0 112.445 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.411 ' O ' HD23 ' A' ' 49' ' ' LEU . 31.0 m -77.38 -31.22 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.13 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.8 mt -61.76 -54.05 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 71.7 m -58.62 -39.5 80.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 124.807 1.317 . . . . 0.0 111.357 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -48.1 83.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.601 0.76 . . . . 0.0 111.195 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 10' ' ' ILE . 3.8 mm? -53.73 -46.32 70.81 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.432 0.693 . . . . 0.0 110.496 174.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.2 mm-40 -55.03 -46.82 75.31 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 124.172 0.92 . . . . 0.0 111.016 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' THR . 16.0 mm-40 -70.5 -52.16 23.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.109 -174.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -68.93 -35.03 76.33 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -97.48 -6.58 33.44 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 64.34 36.9 8.8 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.329 1.052 . . . . 0.0 112.076 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -132.83 -175.48 3.79 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.711 0.404 . . . . 0.0 110.642 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.76 127.64 33.2 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 122.626 0.37 . . . . 0.0 110.917 172.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.22 129.9 36.68 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.429 ' O ' HG13 ' A' ' 62' ' ' ILE . 21.5 t70 -77.16 148.52 35.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.101 0.56 . . . . 0.0 110.37 -175.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.48 -43.21 71.53 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.137 0.975 . . . . 0.0 112.288 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.87 -12.06 61.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.838 0.855 . . . . 0.0 113.015 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -107.47 -15.74 14.54 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 117.918 0.326 . . . . 0.0 110.909 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 58' ' ' ASP . 52.3 mt -74.98 106.53 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 173.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.8 t -126.48 171.28 11.18 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.634 1.173 . . . . 0.0 109.346 173.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.08 -26.7 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 121.137 0.494 . . . . 0.0 109.95 168.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -70.37 -10.7 59.77 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.053 0.941 . . . . 0.0 111.488 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.465 HG22 HD13 ' A' ' 73' ' ' LEU . 56.1 m -72.46 -38.1 68.33 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.907 0.483 . . . . 0.0 109.802 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.593 ' HA ' HD21 ' A' ' 73' ' ' LEU . 74.6 m-85 -99.11 9.24 43.88 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -175.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.18 -44.86 96.63 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.246 0.341 . . . . 0.0 110.921 -176.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 49.6 p -137.28 159.6 41.45 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.923 0.889 . . . . 0.0 110.225 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.96 -34.17 72.91 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 123.871 0.732 . . . . 0.0 111.127 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.27 -40.39 98.53 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 124.518 1.136 . . . . 0.0 112.194 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.414 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 38.9 m -60.84 -50.74 72.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.32 0.648 . . . . 0.0 110.845 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.593 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -58.0 -45.24 87.14 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 123.257 0.348 . . . . 0.0 110.492 176.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.608 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.49 -44.1 80.32 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 124.667 1.229 . . . . 0.0 110.392 -179.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.2 -52.0 64.74 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.422 1.076 . . . . 0.0 110.277 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 31.6 m-85 -54.91 -58.97 5.46 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.118 0.886 . . . . 0.0 110.966 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 73' ' ' LEU . 29.5 m -66.4 -24.08 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.416 0.686 . . . . 0.0 112.791 -176.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 63.3 mm-40 -59.97 -52.13 66.73 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 169.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -65.5 -41.61 93.03 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.012 -172.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.469 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 27.7 mmmt -73.63 -43.93 58.29 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 123.762 0.663 . . . . 0.0 111.741 -172.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.87 -17.01 56.31 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 122.673 0.389 . . . . 0.0 111.548 -177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 120.975 0.417 . . . . 0.0 111.285 174.747 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -36.43 9.92 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.39 1.076 . . . . 0.0 110.739 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -75.74 -12.25 60.15 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.05 0.94 . . . . 0.0 112.941 -168.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -54.91 -30.93 59.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.844 0.715 . . . . 0.0 111.872 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.44 -44.76 70.63 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.885 0.874 . . . . 0.0 110.709 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.421 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.09 -32.06 69.94 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 177.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.69 -47.58 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 122.963 0.505 . . . . 0.0 109.93 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.541 ' HA ' HD12 ' A' ' 11' ' ' LEU . 31.4 ptt180 -68.08 -29.94 69.01 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.383 0.427 . . . . 0.0 109.999 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.569 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.4 t30 -60.89 -46.31 91.15 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.473 0.709 . . . . 0.0 110.025 174.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.475 HG21 HD22 ' A' ' 49' ' ' LEU . 86.1 mt -60.83 -44.8 98.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.418 176.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' A' ' 8' ' ' ARG . 39.9 mt -62.14 -38.17 87.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.061 0.544 . . . . 0.0 111.066 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.587 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -73.34 -25.91 71.68 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.145 -0.48 . . . . 0.0 113.481 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.35 -51.3 17.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.649 0.78 . . . . 0.0 110.554 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.7 t -77.18 -55.32 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.669 -173.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.483 HD11 HD13 ' A' ' 37' ' ' LEU . 33.7 mt -84.02 -4.12 58.51 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.966 -171.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 68.16 44.46 1.41 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 124.694 1.197 . . . . 0.0 111.474 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 9.9 mp -73.61 -36.31 65.47 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.298 174.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 65.6 -87.1 0.09 OUTLIER Glycine 0 C--N 1.354 1.549 0 O-C-N 123.829 0.706 . . . . 0.0 112.659 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.23 -28.14 19.05 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.52 0.728 . . . . 0.0 111.123 177.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.486 HH11 HD23 ' A' ' 24' ' ' LEU . 2.0 tmt_? -67.31 -22.92 65.61 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.937 0.895 . . . . 0.0 110.411 -173.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.3 pttt -67.25 -29.29 68.88 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.028 0.531 . . . . 0.0 111.139 176.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -95.09 -18.96 20.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.452 0.701 . . . . 0.0 110.658 -173.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.405 HG22 ' O ' ' A' ' 20' ' ' ARG . 5.9 t -81.43 -10.98 59.4 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.732 0.413 . . . . 0.0 111.121 176.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.486 HD23 HH11 ' A' ' 20' ' ' ARG . 4.1 pp -102.66 152.8 20.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.813 0.445 . . . . 0.0 110.571 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.7 p -122.97 -171.63 2.33 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.485 1.114 . . . . 0.0 110.095 -174.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.73 67.57 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.308 0.643 . . . . 0.0 112.357 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.1 m -74.86 -26.71 59.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.614 0.766 . . . . 0.0 112.171 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 86.5 p -63.28 131.48 48.49 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 122.938 0.495 . . . . 0.0 111.34 -172.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.03 149.17 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.508 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.2 mt -111.17 -67.9 0.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.6 mt -57.92 112.13 1.39 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.601 0.36 . . . . 0.0 110.328 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 99.1 -28.93 13.01 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 115.426 -0.806 . . . . 0.0 113.569 177.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -88.62 -47.48 8.25 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 117.254 0.527 . . . . 0.0 110.63 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 30' ' ' LEU . 27.9 mm -76.25 115.74 49.78 Favored Pre-proline 0 N--CA 1.472 0.64 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 177.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.91 -5.14 16.43 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 122.381 2.054 . . . . 0.0 112.856 -174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -107.13 -0.24 22.95 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.461 0.704 . . . . 0.0 110.911 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.483 HD13 HD11 ' A' ' 15' ' ' LEU . 39.1 tp -94.74 80.29 3.76 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.466 0.65 . . . . 0.0 109.529 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 42' ' ' VAL . 3.8 p30 -95.97 -165.88 1.35 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.273 1.029 . . . . 0.0 110.275 176.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.623 ' O ' HG22 ' A' ' 42' ' ' VAL . 35.5 t -52.98 -69.58 0.11 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 125.391 1.476 . . . . 0.0 113.05 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 15.5 mmt -66.0 -23.84 66.65 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.793 -0.567 . . . . 0.0 111.388 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.63 83.6 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 175.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 39' ' ' SER . 15.1 m -66.99 -35.75 75.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.549 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 t -65.0 -41.42 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 121.503 0.668 . . . . 0.0 110.701 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -61.93 -46.96 87.04 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 114.445 -1.252 . . . . 0.0 112.089 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.1 m -70.16 -28.99 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 CA-C-O 119.194 -0.431 . . . . 0.0 111.669 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.461 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 84.2 mt -59.0 -55.51 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.412 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 52.3 m -57.62 -42.46 83.34 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.918 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -38.77 90.89 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.941 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.475 HD22 HG21 ' A' ' 10' ' ' ILE . 2.4 mm? -56.98 -48.51 78.24 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.8 mm-40 -52.09 -50.91 60.69 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.491 1.119 . . . . 0.0 110.656 177.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 47' ' ' THR . 61.8 mm-40 -63.66 -58.12 7.91 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.642 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -69.47 -35.54 75.7 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -170.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -89.89 -13.6 36.02 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.13 49.18 2.74 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.088 0.955 . . . . 0.0 111.357 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -143.49 -169.48 3.07 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.087 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.0 t -138.01 131.26 30.45 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.959 0.503 . . . . 0.0 110.664 172.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.0 t -90.89 129.97 40.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 168.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.453 ' O ' HG13 ' A' ' 62' ' ' ILE . 36.2 t70 -74.79 148.39 40.39 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -65.84 -28.41 68.96 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.606 0.363 . . . . 0.0 111.789 -174.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.08 -29.25 66.2 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.71 0.804 . . . . 0.0 111.109 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -94.14 -13.48 26.69 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 122.623 0.369 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 58' ' ' ASP . 61.7 mt -75.7 107.82 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 172.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.5 t -115.7 167.31 11.03 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.933 0.893 . . . . 0.0 109.636 173.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.24 -31.83 73.18 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 165.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -71.26 -10.98 60.65 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.449 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.453 HG22 HD13 ' A' ' 73' ' ' LEU . 41.1 m -79.21 -41.38 28.44 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.585 ' HA ' HD21 ' A' ' 73' ' ' LEU . 43.2 m-85 -99.0 11.95 37.44 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.711 0.804 . . . . 0.0 113.048 -174.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.557 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.4 pt-20 -61.22 -44.62 96.98 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.294 0.638 . . . . 0.0 111.749 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.557 HG22 ' HG3' ' A' ' 68' ' ' GLU . 8.0 t -148.0 158.68 44.18 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 110.229 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.37 -35.89 70.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.572 0.749 . . . . 0.0 111.434 -178.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.87 -42.07 96.47 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.492 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -63.95 -47.31 80.96 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.295 0.638 . . . . 0.0 111.44 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.585 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -57.53 -45.03 85.5 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.49 -44.79 89.54 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.835 1.334 . . . . 0.0 110.899 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -58.73 -51.12 71.33 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 123.972 0.795 . . . . 0.0 110.645 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 22.7 m-85 -56.08 -55.34 34.17 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.74 -24.97 31.6 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 123.055 0.542 . . . . 0.0 111.774 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.3 mm-40 -56.49 -56.88 15.71 Favored 'General case' 0 C--N 1.365 1.248 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -59.85 -46.35 89.55 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.196 0.935 . . . . 0.0 111.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.7 mmmt -57.97 -55.81 30.1 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.365 1.066 . . . . 0.0 112.034 -176.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.29 -13.71 59.73 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.876 -175.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.482 1.137 0 CA-C-N 117.953 0.342 . . . . 0.0 111.445 173.304 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.457 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 1.9 tpt . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.99 -36.74 65.73 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -163.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' ' 7' ' ' VAL . 11.0 m-70 -73.5 -9.31 58.56 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.412 -173.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.7 -32.62 59.75 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.133 0.573 . . . . 0.0 110.166 173.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.56 -52.03 43.54 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.466 -176.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.32 -35.01 75.51 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.14 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 3' ' ' HIS . 97.5 t -66.18 -47.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 122.585 0.354 . . . . 0.0 110.361 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.479 ' HA ' HD12 ' A' ' 11' ' ' LEU . 36.2 ptt180 -69.88 -27.18 64.6 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.646 0.378 . . . . 0.0 110.431 -178.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -61.63 -45.66 93.12 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.222 173.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 6' ' ' ALA . 92.8 mt -64.09 -46.33 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.58 1.152 . . . . 0.0 111.508 177.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 8' ' ' ARG . 52.1 mt -61.58 -43.03 99.61 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.321 0.648 . . . . 0.0 110.966 -177.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.11 -19.14 77.66 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.056 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -75.09 -42.18 57.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 110.232 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 79.9 t -83.14 -46.23 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.26 -172.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -99.02 1.07 45.06 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.896 0.478 . . . . 0.0 111.991 -177.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.7 t30 60.05 63.19 1.48 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.86 1.264 . . . . 0.0 111.367 173.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.476 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 10.0 mp -81.49 -29.67 33.58 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.764 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 72.77 -105.94 1.85 Allowed Glycine 0 C--N 1.348 1.215 0 O-C-N 123.555 0.535 . . . . 0.0 112.35 176.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.6 -24.23 36.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.261 0.624 . . . . 0.0 110.443 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.567 HH11 HD23 ' A' ' 24' ' ' LEU . 2.3 tmt_? -64.78 -35.4 80.98 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.654 0.781 . . . . 0.0 109.66 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 52.6 pttt -67.08 -23.34 65.84 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.525 0.515 . . . . 0.0 111.549 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -94.59 -42.72 8.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 122.634 0.374 . . . . 0.0 110.724 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 20' ' ' ARG . 14.5 t -75.51 3.96 8.38 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.489 0.716 . . . . 0.0 112.43 -172.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.567 HD23 HH11 ' A' ' 20' ' ' ARG . 3.1 pp -95.97 -179.79 4.81 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.758 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 45.3 p -133.12 -171.94 2.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.564 1.146 . . . . 0.0 109.124 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.1 66.3 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.45 0.7 . . . . 0.0 111.728 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.5 m -75.61 -5.42 45.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.984 0.914 . . . . 0.0 111.997 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 29.2 t -71.0 130.47 41.66 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.928 0.491 . . . . 0.0 110.674 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.0 t -87.13 138.43 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.473 ' HA ' HG12 ' A' ' 34' ' ' ILE . 59.6 mt -105.62 -71.58 0.74 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.892 0.477 . . . . 0.0 111.304 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 71.1 mt -53.96 118.98 4.43 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 123.705 0.628 . . . . 0.0 111.02 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.43 -41.65 3.1 Favored Glycine 0 C--N 1.342 0.869 0 O-C-N 123.967 0.792 . . . . 0.0 113.401 177.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -72.14 -48.63 42.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.655 0.782 . . . . 0.0 111.19 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.473 HG12 ' HA ' ' A' ' 30' ' ' LEU . 35.3 mm -73.69 116.99 57.21 Favored Pre-proline 0 CA--C 1.545 0.758 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -74.15 -0.24 9.33 Favored 'Trans proline' 0 C--N 1.369 1.653 0 C-N-CA 122.8 2.333 . . . . 0.0 113.224 -175.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.417 ' H ' HG22 ' A' ' 34' ' ' ILE . 13.6 mm-40 -107.93 -2.4 19.81 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.915 0.886 . . . . 0.0 110.525 178.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 tt -106.19 102.59 11.99 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -175.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -112.48 -164.53 0.92 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.487 1.115 . . . . 0.0 110.583 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.545 ' O ' HG22 ' A' ' 42' ' ' VAL . 45.0 t -45.38 -67.67 0.26 Allowed 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 126.668 1.987 . . . . 0.0 113.231 171.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 22.3 mmt -62.48 -25.97 68.28 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.032 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 45' ' ' VAL . . . -64.99 -38.69 91.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 118.874 -0.584 . . . . 0.0 112.276 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.545 HG22 ' O ' ' A' ' 39' ' ' SER . 2.5 m -61.11 -38.45 79.66 Favored 'Isoleucine or valine' 0 C--N 1.368 1.406 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 176.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.6 t -69.58 -45.43 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.771 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -57.59 -42.72 83.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.124 -1.398 . . . . 0.0 112.077 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 41' ' ' ALA . 21.2 m -78.91 -28.03 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.492 -0.766 . . . . 0.0 112.175 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.6 mt -59.83 -55.59 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 171.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.426 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 30.1 m -54.52 -48.7 71.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.921 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.07 99.12 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.057 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -54.87 -51.66 65.25 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.283 0.633 . . . . 0.0 109.831 175.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.8 mm-40 -54.01 -44.2 70.7 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.471 1.108 . . . . 0.0 111.181 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 47' ' ' THR . 13.1 mm-40 -63.25 -64.15 0.99 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.71 -179.125 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -61.98 -41.43 98.01 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.703 0.801 . . . . 0.0 113.049 -170.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.419 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 65.2 m-85 -88.0 -21.32 24.89 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 118.962 -0.542 . . . . 0.0 112.016 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 63.88 58.95 1.17 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.18 0.992 . . . . 0.0 111.113 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -147.38 -177.19 5.56 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.003 -0.998 . . . . 0.0 109.749 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.2 t -131.1 117.9 19.77 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.531 0.333 . . . . 0.0 111.014 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.6 t -76.8 124.89 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 168.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 34.1 t70 -65.6 135.92 55.68 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.597 0.359 . . . . 0.0 110.315 -176.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -60.83 -27.58 68.18 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.243 0.617 . . . . 0.0 112.037 -173.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -82.07 -19.0 41.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.302 0.641 . . . . 0.0 112.272 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -92.29 -19.67 21.91 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 176.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 58' ' ' ASP . 57.7 mt -72.84 113.51 10.58 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.2 t -129.5 175.62 8.64 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 125.066 1.346 . . . . 0.0 108.389 175.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.45 -30.24 70.55 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 168.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -72.57 -13.6 61.43 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.603 0.761 . . . . 0.0 111.758 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 49.5 m -78.31 -32.42 49.27 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.054 0.542 . . . . 0.0 109.625 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.491 ' HA ' HD21 ' A' ' 73' ' ' LEU . 59.1 m-85 -108.94 7.16 25.83 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.633 0.773 . . . . 0.0 112.998 -177.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.96 -40.53 95.14 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 117.655 0.207 . . . . 0.0 111.043 -176.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.7 p -135.65 163.86 29.18 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.727 0.811 . . . . 0.0 110.241 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.48 -35.83 78.76 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.582 173.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.42 -30.99 75.79 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.026 0.829 . . . . 0.0 112.68 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.4 m -67.92 -51.73 44.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.353 0.661 . . . . 0.0 110.458 176.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.92 -46.99 86.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 122.915 0.134 . . . . 0.0 110.864 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -52.74 -50.39 63.55 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.596 1.185 . . . . 0.0 109.742 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.32 -56.48 18.09 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.582 1.153 . . . . 0.0 110.426 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.461 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.4 m-85 -57.21 -54.76 43.08 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.95 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 17.2 m -67.79 -25.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.048 0.539 . . . . 0.0 111.616 -176.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 69.1 mm-40 -60.56 -46.65 89.42 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 171.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -59.03 -50.74 72.94 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 123.518 0.511 . . . . 0.0 110.665 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -63.48 -50.99 67.5 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.715 -170.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.12 -13.93 60.9 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.155 0.582 . . . . 0.0 112.157 -177.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.48 1.032 0 C-N-CA 122.69 0.396 . . . . 0.0 111.553 172.543 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.22 0.533 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . 0.439 HE21 ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -99.24 -34.48 10.32 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.096 0.959 . . . . 0.0 110.394 170.421 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.406 ' O ' HG23 ' A' ' 7' ' ' VAL . 15.7 m-70 -75.06 -20.05 59.72 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -53.71 -28.95 36.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 123.57 0.543 . . . . 0.0 111.898 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -65.26 -48.38 73.41 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 123.514 0.726 . . . . 0.0 111.083 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.13 -30.81 62.48 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.169 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 3' ' ' HIS . 91.7 t -65.08 -46.6 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 39.6 ptt180 -74.56 -24.89 59.0 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.988 0.515 . . . . 0.0 110.641 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.431 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 48.7 t30 -61.45 -47.04 87.55 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 172.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.403 HG21 HD22 ' A' ' 49' ' ' LEU . 93.6 mt -62.35 -45.66 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.955 176.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.41 -42.9 98.76 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.797 0.439 . . . . 0.0 110.961 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.518 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -70.58 -18.93 76.01 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.206 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -81.85 -52.49 7.05 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.053 0.541 . . . . 0.0 111.161 174.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.9 t -68.05 -57.99 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.321 0.648 . . . . 0.0 109.84 -175.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.471 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.0 mm? -81.21 -10.93 59.53 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 123.649 0.593 . . . . 0.0 111.272 -176.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 66.65 47.94 1.51 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.454 1.102 . . . . 0.0 110.868 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 3.5 mm? -66.53 -34.38 77.79 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 171.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.95 -93.27 0.15 Allowed Glycine 0 C--N 1.355 1.588 0 O-C-N 123.938 0.774 . . . . 0.0 112.988 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -79.19 -34.52 42.95 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.353 1.061 . . . . 0.0 110.413 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HA ' HG22 ' A' ' 23' ' ' THR . 1.7 tmt_? -68.58 -25.34 64.84 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.577 -171.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 56.1 pttt -64.98 -29.06 69.96 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.476 0.179 . . . . 0.0 111.33 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -85.53 -29.9 23.84 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 122.864 0.465 . . . . 0.0 110.982 -175.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 20' ' ' ARG . 12.1 t -84.37 -9.86 58.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.045 0.538 . . . . 0.0 111.819 -176.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 pp -94.22 151.79 19.19 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 177.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.0 p -112.67 -173.54 2.27 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.809 0.844 . . . . 0.0 109.938 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 -23.62 66.11 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.042 0.537 . . . . 0.0 111.332 172.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.3 m -81.16 0.98 33.93 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.26 1.024 . . . . 0.0 112.734 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.7 t -81.94 137.7 35.12 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.653 0.381 . . . . 0.0 110.651 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -86.91 145.76 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 124.331 1.052 . . . . 0.0 109.188 175.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.4 mt -108.18 -70.68 0.79 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.233 0.613 . . . . 0.0 110.676 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.483 HD23 HD12 ' A' ' 37' ' ' LEU . 21.4 mt -51.3 113.99 1.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.243 1.017 . . . . 0.0 112.269 178.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.49 -27.93 4.03 Favored Glycine 0 C--N 1.348 1.202 0 O-C-N 123.942 0.777 . . . . 0.0 114.059 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -76.7 -59.74 2.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.319 0.648 . . . . 0.0 109.915 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.439 HG22 ' H ' ' A' ' 36' ' ' GLU . 43.9 mm -70.84 121.98 85.49 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 173.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -69.37 -9.22 25.67 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 122.653 2.235 . . . . 0.0 112.452 -175.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 16.6 mm-40 -94.48 -21.87 18.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.831 0.853 . . . . 0.0 110.528 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.483 HD12 HD23 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -82.45 80.77 8.52 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -174.191 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 11.3 t70 -112.55 -168.45 1.32 Allowed 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 125.204 1.402 . . . . 0.0 109.516 -177.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.2 t -51.06 -70.42 0.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 125.751 1.621 . . . . 0.0 114.486 -173.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.8 mmm -65.0 -22.06 66.94 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.632 -0.667 . . . . 0.0 111.251 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.471 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -67.07 -35.96 80.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.481 0.713 . . . . 0.0 111.932 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -64.54 -37.9 81.24 Favored 'Isoleucine or valine' 0 C--N 1.372 1.545 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.1 t -67.66 -44.33 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.684 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -61.7 -38.85 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.132 -1.394 . . . . 0.0 112.532 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.416 ' O ' HD23 ' A' ' 49' ' ' LEU . 30.1 m -80.1 -29.15 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.097 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.559 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -59.8 -57.06 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 171.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.9 m -55.72 -44.39 77.43 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.624 1.202 . . . . 0.0 111.37 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.49 -47.79 84.13 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.003 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -52.17 -49.75 63.18 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.424 0.69 . . . . 0.0 110.174 174.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.9 mm-40 -57.47 -43.25 83.89 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.994 0.918 . . . . 0.0 111.368 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -67.08 -52.45 41.93 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.785 0.834 . . . . 0.0 112.59 -176.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -69.57 -39.35 77.42 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.404 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 72.7 m-85 -91.03 -16.8 27.32 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 57.97 64.27 1.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 124.611 1.164 . . . . 0.0 111.11 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.404 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -149.24 -176.36 5.34 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.679 0.792 . . . . 0.0 109.622 178.156 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -134.89 116.73 15.08 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 122.357 0.263 . . . . 0.0 111.421 171.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.556 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.8 t -69.34 127.85 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 168.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.466 ' O ' HG13 ' A' ' 62' ' ' ILE . 32.0 t70 -72.41 142.86 48.68 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 118.142 0.428 . . . . 0.0 110.767 -173.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -50.3 -44.65 54.1 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.521 1.128 . . . . 0.0 112.592 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.7 -21.76 64.39 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.107 -174.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -97.98 -20.97 17.09 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.157 0.183 . . . . 0.0 110.909 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 58' ' ' ASP . 60.9 mt -75.47 117.48 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 0.0 110.264 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 t -144.37 179.59 7.15 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 124.117 0.967 . . . . 0.0 109.491 174.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.7 74.02 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.71 0.804 . . . . 0.0 110.151 167.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -67.84 -17.15 64.41 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -81.11 -37.82 28.27 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.453 0.701 . . . . 0.0 110.024 174.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.504 ' HA ' HD21 ' A' ' 73' ' ' LEU . 39.2 m-85 -104.85 14.7 29.11 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.28 0.632 . . . . 0.0 112.402 -176.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.54 -46.14 89.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.65 0.38 . . . . 0.0 110.605 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.3 p -137.28 158.41 44.49 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.638 0.775 . . . . 0.0 110.43 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.3 tp -55.41 -39.72 70.56 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.504 0.722 . . . . 0.0 110.71 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.46 95.76 Favored Glycine 0 C--N 1.347 1.176 0 O-C-N 124.452 1.095 . . . . 0.0 112.474 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -60.09 -45.31 93.38 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 122.787 0.435 . . . . 0.0 110.978 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.86 -42.18 99.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 122.999 0.187 . . . . 0.0 110.759 175.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.564 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.16 -49.03 79.42 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 124.153 0.908 . . . . 0.0 111.03 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.84 -43.74 92.07 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.634 0.774 . . . . 0.0 110.696 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.517 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 7.1 m-85 -58.08 -52.0 67.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 119.235 -0.412 . . . . 0.0 110.587 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.3 m -70.88 -24.73 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.003 0.521 . . . . 0.0 111.975 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 78.6 mm-40 -56.71 -44.85 81.99 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 168.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -73.19 -39.42 65.6 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.307 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.556 ' HE2' ' HA ' ' A' ' 57' ' ' VAL . 32.5 mmmt -64.91 -53.0 53.39 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.481 0.712 . . . . 0.0 111.912 -173.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.07 -13.1 60.45 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.436 -177.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 123.78 0.832 . . . . 0.0 111.845 172.472 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.618 0.247 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -98.02 -37.82 9.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.009 0.923 . . . . 0.0 110.323 172.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -75.14 -12.98 60.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.992 0.917 . . . . 0.0 113.102 -169.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -57.67 -22.13 44.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 123.541 0.526 . . . . 0.0 111.689 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.3 -58.98 6.18 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.265 1.026 . . . . 0.0 110.926 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.66 58.82 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.783 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 87.4 t -63.53 -54.84 27.41 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -69.28 -28.04 65.95 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.289 0.236 . . . . 0.0 110.516 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -60.1 -52.57 64.77 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.319 0.647 . . . . 0.0 109.906 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.434 HG21 HD22 ' A' ' 49' ' ' LEU . 92.6 mt -64.05 -51.9 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.997 -178.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.413 HD13 HD13 ' A' ' 30' ' ' LEU . 76.7 mt -61.05 -39.63 90.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.074 0.55 . . . . 0.0 111.59 -175.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.571 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.1 -23.94 70.24 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 121.329 -0.462 . . . . 0.0 113.366 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.34 -27.01 38.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.033 0.533 . . . . 0.0 110.915 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.2 t -86.28 -59.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.336 0.655 . . . . 0.0 109.644 177.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.462 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -77.38 3.77 12.42 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -174.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 71.5 38.01 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.293 1.037 . . . . 0.0 111.192 167.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.412 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.6 mp -75.78 -32.08 59.77 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.165 172.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.5 -95.9 0.27 Allowed Glycine 0 C--N 1.353 1.51 0 O-C-N 123.556 0.535 . . . . 0.0 113.224 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -90.11 -25.29 20.8 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.025 0.93 . . . . 0.0 110.897 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.11 -26.82 69.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.574 0.749 . . . . 0.0 111.348 -175.523 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.8 pttt -66.26 -30.32 70.73 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.041 0.537 . . . . 0.0 111.731 178.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -81.91 -22.3 36.87 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.513 0.725 . . . . 0.0 111.081 -175.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 t -93.49 2.62 56.38 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.836 0.454 . . . . 0.0 112.054 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.439 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -108.06 159.06 16.87 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.951 -0.468 . . . . 0.0 110.743 176.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -116.26 -174.92 2.64 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.663 0.785 . . . . 0.0 110.915 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -67.3 -17.69 64.88 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.28 0.632 . . . . 0.0 111.933 175.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -74.23 -24.03 59.25 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.34 0.656 . . . . 0.0 111.46 173.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.1 t -63.54 125.43 24.22 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.712 0.805 . . . . 0.0 111.455 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.8 t -79.23 147.14 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.413 HD13 HD13 ' A' ' 11' ' ' LEU . 67.5 mt -116.43 -68.14 0.94 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.241 0.616 . . . . 0.0 110.07 -177.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 tt -61.86 111.23 1.8 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.54 -26.95 22.67 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.461 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -88.92 -49.89 6.52 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 117.321 0.56 . . . . 0.0 110.671 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.4 mm -81.35 118.48 72.46 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.93 -6.68 18.4 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.686 2.257 . . . . 0.0 112.848 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -94.24 -18.14 21.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.88 0.872 . . . . 0.0 111.06 -175.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.5 tp -86.66 88.52 7.68 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 122.917 0.487 . . . . 0.0 109.719 -174.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.518 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 13.0 t70 -120.76 -170.68 2.04 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.045 0.938 . . . . 0.0 109.66 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.6 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.1 t -40.27 -69.4 0.13 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 127.615 2.366 . . . . 0.0 114.883 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -66.89 -29.76 69.74 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.211 -0.931 . . . . 0.0 111.761 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.518 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -66.79 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 39' ' ' SER . 28.6 m -70.42 -33.32 53.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.2 -46.79 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.509 0.671 . . . . 0.0 110.033 175.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -56.68 -48.71 77.04 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.27 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.409 HG22 ' HA ' ' A' ' 42' ' ' VAL . 27.6 m -72.45 -32.9 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.915 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.536 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -60.01 -52.26 63.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.3 m -55.06 -44.61 74.93 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 124.579 1.175 . . . . 0.0 111.177 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -42.35 99.66 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.763 0.825 . . . . 0.0 111.883 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.434 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -57.82 -46.29 84.92 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.071 0.548 . . . . 0.0 110.232 173.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.8 mm-40 -54.46 -44.18 72.33 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.232 1.013 . . . . 0.0 110.827 178.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' THR . 43.4 mm-40 -63.01 -57.18 11.56 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.724 -176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -66.35 -44.91 81.93 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.604 0.565 . . . . 0.0 112.258 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -88.56 -9.46 52.21 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 118.941 -0.552 . . . . 0.0 112.359 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 59.47 45.28 13.78 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.271 1.028 . . . . 0.0 111.656 175.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -139.02 -177.02 4.7 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.425 -174.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.7 t -134.49 113.66 12.05 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.2 t -69.06 131.91 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 16.9 t70 -67.37 134.04 50.73 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.46 0.704 . . . . 0.0 110.158 -176.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -57.98 -38.42 76.05 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.886 0.875 . . . . 0.0 112.949 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -72.35 -20.18 61.51 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.938 0.495 . . . . 0.0 111.995 -176.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 18.3 pt-20 -98.71 -8.92 25.34 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.382 0.273 . . . . 0.0 110.641 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 51.5 mt -87.09 117.81 31.94 Favored 'Isoleucine or valine' 0 C--N 1.359 0.979 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.8 t -155.91 -172.3 4.07 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.308 1.043 . . . . 0.0 108.459 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.85 77.75 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.719 0.408 . . . . 0.0 110.655 176.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.1 mm-40 -68.55 -12.26 61.04 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.149 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.48 HG22 HD13 ' A' ' 73' ' ' LEU . 23.2 m -81.29 -45.14 16.66 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.215 0.606 . . . . 0.0 109.606 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.542 ' HA ' HD21 ' A' ' 73' ' ' LEU . 70.0 m-85 -97.75 6.25 48.14 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -174.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.497 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -57.03 -45.13 83.33 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.724 0.64 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.497 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -146.63 160.21 42.46 Favored 'General case' 0 C--O 1.249 1.058 0 C-N-CA 123.466 0.707 . . . . 0.0 110.036 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 17.3 tp -58.84 -35.66 73.27 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.774 0.83 . . . . 0.0 110.852 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.82 -42.14 96.4 Favored Glycine 0 C--N 1.349 1.276 0 O-C-N 124.635 1.209 . . . . 0.0 112.107 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.5 m -62.58 -49.45 75.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.974 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -57.69 -46.22 84.61 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.137 0.426 . . . . 0.0 110.196 178.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.561 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.46 -39.37 90.65 Favored 'General case' 0 C--O 1.217 -0.65 0 O-C-N 124.529 1.143 . . . . 0.0 111.305 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.78 -49.68 67.47 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.733 0.813 . . . . 0.0 110.621 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 42.4 m-85 -55.72 -49.67 72.42 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.55 0.531 . . . . 0.0 110.32 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.2 m -70.73 -25.66 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -55.69 -48.81 74.48 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -66.9 -41.27 87.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.146 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -63.2 -54.1 42.84 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.65 0.78 . . . . 0.0 112.238 -173.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.44 -13.5 61.08 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.328 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 123.422 0.689 . . . . 0.0 111.45 174.092 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.613 ' SD ' ' HG3' ' A' ' 78' ' ' GLU . 7.1 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . 0.445 HE21 ' N ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -98.23 -39.32 8.91 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 0.0 111.724 -175.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' HG23 ' A' ' 7' ' ' VAL . 41.7 m-70 -76.8 -10.97 59.75 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.24 -170.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -55.35 -31.88 62.08 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 118.664 0.666 . . . . 0.0 111.799 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.72 -41.54 59.98 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.447 0.699 . . . . 0.0 111.435 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.438 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.27 -37.22 83.09 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.959 176.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -67.1 -47.3 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.052 178.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.41 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 28.7 ptt180 -68.65 -25.93 65.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.563 0.345 . . . . 0.0 110.476 -179.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 23.8 t30 -61.86 -50.49 72.02 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.67 0.788 . . . . 0.0 109.531 173.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.558 HG21 HD22 ' A' ' 49' ' ' LEU . 91.5 mt -59.83 -42.72 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.651 1.18 . . . . 0.0 111.281 178.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 46.0 mt -68.96 -41.75 77.54 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.136 0.574 . . . . 0.0 111.056 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.461 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -71.91 -18.27 77.51 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 116.147 -0.478 . . . . 0.0 113.148 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -79.95 -53.75 6.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.848 0.859 . . . . 0.0 110.006 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.495 HG13 ' ND2' ' A' ' 44' ' ' ASN . 79.5 t -73.32 -49.54 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.09 0.956 . . . . 0.0 111.387 -173.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.413 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 0.9 OUTLIER -83.93 -3.09 57.69 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.269 0.228 . . . . 0.0 110.84 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 61.64 53.45 3.26 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 124.962 1.305 . . . . 0.0 111.214 172.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.446 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.8 mp -75.81 -28.16 58.22 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.8 171.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.46 -89.03 0.08 OUTLIER Glycine 0 C--N 1.353 1.491 0 O-C-N 124.211 0.944 . . . . 0.0 112.408 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -93.24 -29.34 15.74 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.827 0.851 . . . . 0.0 111.448 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.68 -26.35 66.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.99 0.516 . . . . 0.0 111.355 -170.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 58.1 pttt -58.57 -28.11 65.23 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.701 0.4 . . . . 0.0 111.569 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -79.08 -25.73 43.06 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.81 0.844 . . . . 0.0 110.957 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.1 t -93.81 1.46 56.44 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.614 0.366 . . . . 0.0 111.926 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -109.72 151.46 26.89 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.895 -0.503 . . . . 0.0 110.038 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.8 p -123.51 -171.73 2.37 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.688 0.795 . . . . 0.0 109.996 -175.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.7 -20.3 65.94 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.442 0.697 . . . . 0.0 112.478 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 m -75.89 -21.74 56.83 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.193 0.597 . . . . 0.0 111.859 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -71.55 137.62 48.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.669 0.787 . . . . 0.0 111.422 -175.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.88 160.72 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 C-N-CA 124.573 1.149 . . . . 0.0 109.224 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.6 mt -117.1 -68.51 0.91 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.03 109.31 1.24 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.805 174.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.25 -34.27 5.81 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.273 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -77.27 -57.65 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.425 HG22 ' H ' ' A' ' 36' ' ' GLU . 12.9 mm -81.73 116.46 63.3 Favored Pre-proline 0 CA--C 1.543 0.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -175.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -77.18 -8.08 17.4 Favored 'Trans proline' 0 C--N 1.369 1.633 0 C-N-CA 122.459 2.106 . . . . 0.0 112.02 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.425 ' H ' HG22 ' A' ' 34' ' ' ILE . 6.0 mm-40 -96.48 -6.82 36.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.983 0.913 . . . . 0.0 110.659 -178.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.1 tp -81.72 80.76 7.97 Favored 'General case' 0 C--N 1.349 0.584 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.431 ' N ' ' HB3' ' A' ' 41' ' ' ALA . 22.3 t70 -82.01 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.476 1.511 . . . . 0.0 110.607 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' VAL . 48.1 t -43.95 -66.73 0.35 Allowed 'General case' 0 CA--C 1.566 1.577 0 C-N-CA 126.163 1.785 . . . . 0.0 112.469 170.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 95.0 mmm -70.56 -15.26 62.75 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.652 -0.655 . . . . 0.0 111.748 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.431 ' HB3' ' N ' ' A' ' 38' ' ' ASP . . . -77.22 -25.34 51.56 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.319 174.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' SER . 4.7 m -69.61 -37.99 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.12 -42.33 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.648 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.495 ' ND2' HG13 ' A' ' 14' ' ' VAL . 59.6 t30 -68.26 -37.75 81.07 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.553 -176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.2 m -72.53 -35.71 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.69 177.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.503 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 93.1 mt -59.97 -48.51 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 33.0 m -56.86 -45.06 82.72 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 124.373 1.046 . . . . 0.0 110.732 177.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.26 -41.65 98.63 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.689 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.558 HD22 HG21 ' A' ' 10' ' ' ILE . 3.4 mm? -56.58 -46.68 80.67 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.197 0.599 . . . . 0.0 109.9 176.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.2 mm-40 -51.66 -50.52 60.2 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.266 1.026 . . . . 0.0 110.386 176.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.2 mm-40 -59.81 -63.96 1.11 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.76 -176.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -65.05 -46.02 82.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.651 -169.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -87.67 -7.66 57.13 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.1 t70 65.19 36.41 7.17 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.93 0.892 . . . . 0.0 111.042 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.19 -175.53 3.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.413 0.685 . . . . 0.0 110.118 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -123.14 135.64 54.44 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 37.2 t -84.75 125.19 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 170.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' HG13 ' A' ' 62' ' ' ILE . 30.2 t70 -75.13 151.33 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.148 0.579 . . . . 0.0 111.083 -174.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -53.45 -41.76 66.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.406 1.082 . . . . 0.0 113.137 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -67.58 -17.96 64.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.836 0.854 . . . . 0.0 111.962 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -115.44 8.01 15.16 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.524 0.729 . . . . 0.0 111.436 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 58' ' ' ASP . 28.9 mt -98.41 105.44 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 77.5 p -146.27 173.23 12.43 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.645 0.778 . . . . 0.0 109.532 171.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.76 71.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 169.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.33 -21.1 66.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.147 0.579 . . . . 0.0 111.469 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.2 m -72.52 -40.31 66.89 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.259 0.624 . . . . 0.0 110.071 175.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.717 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.3 m-85 -97.43 18.32 15.55 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.634 0.774 . . . . 0.0 113.037 -174.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.533 ' HG3' HG22 ' A' ' 69' ' ' THR . 9.5 pt-20 -63.58 -46.34 86.29 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.681 0.392 . . . . 0.0 111.629 178.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.533 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -145.51 155.05 42.85 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 123.354 0.662 . . . . 0.0 110.531 -177.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.56 -32.73 67.41 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.724 0.81 . . . . 0.0 111.296 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.15 -41.68 98.25 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.953 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.2 m -60.4 -52.92 63.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.915 0.486 . . . . 0.0 110.33 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.717 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -61.34 -39.73 91.64 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 123.568 0.542 . . . . 0.0 110.938 -178.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.567 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.08 -49.68 75.1 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.424 1.077 . . . . 0.0 109.988 178.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.14 -39.46 89.86 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.708 0.63 . . . . 0.0 111.702 -177.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.508 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 34.9 m-85 -59.79 -54.75 42.64 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.7 m -67.1 -26.16 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 122.829 0.451 . . . . 0.0 111.787 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.613 ' HG3' ' SD ' ' A' ' 1' ' ' MET . 76.4 mm-40 -57.23 -51.9 67.49 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 170.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 47.9 m170 -63.01 -49.38 74.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.134 -175.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.1 mmmt -60.54 -55.15 36.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.784 0.834 . . . . 0.0 112.04 -172.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.59 -14.32 61.59 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.871 -176.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 122.963 0.505 . . . . 0.0 111.442 173.997 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.581 ' HG2' ' HB1' ' A' ' 74' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -96.88 -44.28 7.11 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 118.446 0.566 . . . . 0.0 112.067 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.423 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 82.6 m-70 -75.11 -12.86 60.4 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.939 -169.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.29 -31.2 63.43 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 118.216 0.462 . . . . 0.0 111.4 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -66.53 -52.88 41.0 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 125.006 1.322 . . . . 0.0 110.628 -178.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.1 -32.25 71.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.506 -178.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 3' ' ' HIS . 86.5 t -68.43 -48.67 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.742 0.417 . . . . 0.0 110.354 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 40.7 ptt180 -67.55 -30.11 69.67 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.449 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 37.4 t30 -62.24 -46.64 87.92 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.531 0.733 . . . . 0.0 109.914 176.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 6' ' ' ALA . 69.8 mt -61.71 -56.38 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 O-C-N 124.366 1.041 . . . . 0.0 111.672 179.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.547 HD22 HD13 ' A' ' 30' ' ' LEU . 9.7 mp -64.83 -34.03 77.4 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.922 0.139 . . . . 0.0 111.351 -176.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.54 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.79 -18.22 79.1 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 119.813 -0.437 . . . . 0.0 113.309 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.28 -53.04 7.34 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.742 0.417 . . . . 0.0 110.289 174.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.73 -58.57 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.325 1.05 . . . . 0.0 109.829 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 37' ' ' LEU . 64.0 mt -77.15 -8.21 57.14 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.135 -175.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.57 62.94 1.05 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.475 1.11 . . . . 0.0 110.717 172.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 4.1 mm? -85.27 -27.96 25.64 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.587 170.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 69.1 -107.5 2.12 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.873 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.33 -26.22 51.88 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.632 0.773 . . . . 0.0 111.147 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.574 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.68 -32.93 74.09 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.879 0.872 . . . . 0.0 110.068 -172.172 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.54 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.5 pttt -64.37 -34.83 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.95 -177.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -89.49 -21.19 23.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.218 0.207 . . . . 0.0 110.499 -173.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.437 HG22 ' HA ' ' A' ' 20' ' ' ARG . 6.8 t -91.96 7.14 43.51 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.027 0.531 . . . . 0.0 110.94 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -109.0 156.15 20.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.893 0.477 . . . . 0.0 109.77 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 p -111.88 -178.26 3.39 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.248 1.019 . . . . 0.0 110.709 -175.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.504 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -66.53 -27.66 67.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.363 0.665 . . . . 0.0 111.315 177.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.4 p -78.32 -4.04 46.06 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.65 0.78 . . . . 0.0 112.419 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.9 t -80.6 141.01 35.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.137 0.575 . . . . 0.0 110.198 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.3 t -80.65 151.63 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.437 1.095 . . . . 0.0 109.026 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 11' ' ' LEU . 82.5 mt -118.58 -69.74 0.83 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.131 0.572 . . . . 0.0 109.929 177.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.8 122.46 18.17 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 175.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.48 -34.78 5.04 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.006 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -86.32 -67.49 0.81 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.195 0.598 . . . . 0.0 111.014 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.453 HG22 ' H ' ' A' ' 36' ' ' GLU . 37.2 mm -64.47 119.66 58.69 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 123.278 0.631 . . . . 0.0 109.981 -172.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -72.9 -6.38 18.91 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.719 2.279 . . . . 0.0 112.699 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.453 ' H ' HG22 ' A' ' 34' ' ' ILE . 22.4 mm-40 -96.48 -14.6 22.24 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.756 0.822 . . . . 0.0 110.872 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.524 HD23 HD11 ' A' ' 15' ' ' LEU . 3.1 tm? -84.93 85.29 7.49 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -178.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.493 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 8.3 t70 -108.79 -173.19 2.21 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.377 1.071 . . . . 0.0 108.846 177.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -49.37 -70.93 0.07 Allowed 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 125.711 1.604 . . . . 0.0 114.5 -173.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -62.75 -25.58 68.27 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 121.708 -0.62 . . . . 0.0 111.358 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.493 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -69.43 -29.53 67.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.312 0.645 . . . . 0.0 112.355 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -65.98 -40.5 87.53 Favored 'Isoleucine or valine' 0 C--N 1.37 1.478 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 172.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.9 t -67.15 -40.43 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.463 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -65.12 -43.12 92.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.272 . . . . 0.0 112.037 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.0 m -72.52 -33.13 44.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.089 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -60.92 -48.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 173.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.463 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 68.1 m -55.77 -44.04 77.29 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 124.301 1.001 . . . . 0.0 110.528 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.57 86.54 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.212 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.442 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -54.21 -50.63 66.66 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 172.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -54.89 -46.04 74.76 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.17 177.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 47' ' ' THR . 30.0 mm-40 -61.66 -60.58 3.46 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.061 0.944 . . . . 0.0 112.093 -177.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -66.91 -46.29 75.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -172.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.502 ' HB3' HD11 ' A' ' 81' ' ' LEU . 93.4 m-85 -84.1 -19.64 33.92 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-O 119.082 -0.485 . . . . 0.0 112.078 -177.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.56 47.74 1.59 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.248 1.019 . . . . 0.0 111.633 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.456 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.5 OUTLIER -137.6 -174.27 3.72 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.906 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.8 t -134.84 117.08 15.52 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 122.767 0.427 . . . . 0.0 110.962 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.424 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 11.7 t -68.96 132.79 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 33.5 t70 -76.26 147.08 38.53 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.592 0.357 . . . . 0.0 110.392 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -57.39 -42.34 81.98 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.199 0.599 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.08 -14.96 62.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.209 0.604 . . . . 0.0 112.289 -174.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.8 pt-20 -103.31 -11.34 17.99 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.864 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 54.5 mt -85.92 116.17 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.234 0.614 . . . . 0.0 110.392 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -145.85 -178.96 6.38 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.879 1.272 . . . . 0.0 108.849 171.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 -34.37 78.22 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 171.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -71.94 -11.17 60.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.671 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.6 m -76.29 -36.67 58.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.226 0.61 . . . . 0.0 110.058 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.596 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.9 m-85 -99.79 14.76 29.18 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.948 0.499 . . . . 0.0 112.082 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -60.89 -45.62 93.86 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.432 0.293 . . . . 0.0 110.659 -178.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.0 p -138.04 163.59 31.22 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.784 0.833 . . . . 0.0 110.168 176.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.504 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 55.0 tp -59.29 -37.18 77.06 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.029 176.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.1 -34.3 89.57 Favored Glycine 0 C--N 1.34 0.753 0 CA-C-N 114.684 -1.144 . . . . 0.0 112.346 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -60.31 -54.89 40.24 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 122.859 0.464 . . . . 0.0 109.885 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.96 -44.3 91.46 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 124.025 0.828 . . . . 0.0 110.313 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -54.5 -46.87 73.55 Favored 'General case' 0 C--O 1.217 -0.636 0 O-C-N 124.64 1.212 . . . . 0.0 110.969 -178.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.48 HD22 ' SD ' ' A' ' 1' ' ' MET . 3.6 mm? -65.87 -47.64 74.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.813 0.845 . . . . 0.0 111.346 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 52.6 m-85 -56.39 -53.03 62.14 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.7 m -70.68 -23.81 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.653 0.781 . . . . 0.0 112.205 -177.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -54.19 -52.88 59.8 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -70.64 -29.6 66.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.989 -1.46 . . . . 0.0 112.114 -173.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -72.04 -58.09 3.73 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.478 0.711 . . . . 0.0 110.847 178.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 53' ' ' PHE . 3.9 mm? -68.2 -11.24 58.95 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.556 -176.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 N--CA 1.484 1.234 0 C-N-CA 123.131 0.572 . . . . 0.0 111.113 167.378 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.949 0.404 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -94.1 -55.03 3.35 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.888 0.851 . . . . 0.0 109.343 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.403 ' O ' HG23 ' A' ' 7' ' ' VAL . 9.9 m-70 -78.21 -9.2 59.1 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.593 -163.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -53.2 -32.48 48.25 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.551 0.74 . . . . 0.0 111.887 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -66.12 -50.64 63.32 Favored 'General case' 0 C--N 1.348 0.514 0 C-N-CA 124.576 1.151 . . . . 0.0 111.074 -177.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.71 -29.58 63.5 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.503 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 3' ' ' HIS . 90.1 t -67.82 -48.28 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.845 0.458 . . . . 0.0 109.995 177.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -70.3 -28.26 65.04 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.542 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 44.0 t30 -63.13 -46.52 86.88 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.326 0.651 . . . . 0.0 109.831 173.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.57 -53.86 42.45 Favored 'Isoleucine or valine' 0 C--N 1.351 0.643 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.258 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.54 -34.8 79.09 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.195 0.31 . . . . 0.0 110.551 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -67.56 -20.53 71.96 Favored Glycine 0 C--N 1.343 0.963 0 CA-C-O 119.947 -0.363 . . . . 0.0 113.398 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -86.06 -56.9 3.24 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.634 0.774 . . . . 0.0 111.059 173.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.9 t -66.07 -54.0 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.602 1.161 . . . . 0.0 111.141 -173.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 64.6 mt -80.61 -14.53 58.1 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.935 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 64.22 62.0 0.87 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.835 1.254 . . . . 0.0 110.863 172.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.635 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 1.7 mm? -86.26 -26.09 25.19 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.3 172.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.43 -83.94 0.14 Allowed Glycine 0 C--N 1.348 1.217 0 O-C-N 124.048 0.843 . . . . 0.0 113.256 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.18 -25.67 14.19 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.641 0.776 . . . . 0.0 111.025 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.635 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.26 -28.03 68.4 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.209 0.603 . . . . 0.0 111.078 -175.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.3 pttt -58.76 -34.0 70.91 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.228 0.611 . . . . 0.0 111.369 173.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -90.81 -10.61 42.16 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.98 0.912 . . . . 0.0 111.803 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.5 t -97.51 -7.06 32.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.701 0.401 . . . . 0.0 111.52 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -103.07 147.57 26.8 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 49.8 p -113.82 -172.56 2.11 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.673 0.789 . . . . 0.0 110.653 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.88 -53.46 57.04 Favored 'General case' 0 C--N 1.35 0.629 0 C-N-CA 123.313 0.645 . . . . 0.0 111.658 -178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -69.54 -5.46 24.41 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -77.95 150.42 34.0 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-O 121.014 0.435 . . . . 0.0 110.365 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.408 ' HB ' ' HB2' ' A' ' 33' ' ' ASN . 90.2 t -83.49 151.69 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.928 -174.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.428 HD12 HD23 ' A' ' 73' ' ' LEU . 95.1 mt -114.82 -62.53 1.59 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.024 0.53 . . . . 0.0 109.614 173.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.444 ' HG ' HD12 ' A' ' 37' ' ' LEU . 3.4 tt -65.61 110.48 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.77 -40.71 2.37 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 116.366 -0.379 . . . . 0.0 112.522 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.408 ' HB2' ' HB ' ' A' ' 29' ' ' VAL . 62.6 t30 -77.63 -40.71 40.96 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.13 0.49 . . . . 0.0 110.54 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.54 HG22 ' H ' ' A' ' 36' ' ' GLU . 39.8 mm -84.51 121.92 75.01 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 175.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.05 -17.42 31.77 Favored 'Trans proline' 0 C--N 1.371 1.744 0 C-N-CA 122.648 2.232 . . . . 0.0 112.155 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 19.5 mm-40 -93.92 -12.53 28.63 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.987 0.915 . . . . 0.0 111.389 -172.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.444 HD12 ' HG ' ' A' ' 31' ' ' LEU . 2.9 tm? -76.92 94.89 4.0 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.509 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 16.6 t70 -132.45 -168.82 2.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.184 0.994 . . . . 0.0 110.005 -171.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.558 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -56.07 -72.92 0.07 Allowed 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 125.988 1.715 . . . . 0.0 114.599 -170.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.414 ' SD ' H311 ' A' ' 84' ' ' PNS . 25.2 mmt -70.45 -21.11 62.83 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 121.165 -0.959 . . . . 0.0 110.845 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.509 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -68.37 -34.62 76.39 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.342 177.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 39' ' ' SER . 34.3 m -70.58 -38.06 72.07 Favored 'Isoleucine or valine' 0 C--N 1.372 1.556 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -59.46 -43.34 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.417 0.627 . . . . 0.0 110.161 176.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.26 -45.94 85.91 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.053 -1.43 . . . . 0.0 111.482 -175.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.2 m -68.74 -33.62 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-O 118.894 -0.574 . . . . 0.0 111.533 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.524 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.5 mt -60.42 -52.25 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 40.1 m -54.18 -46.23 72.31 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 124.646 1.217 . . . . 0.0 110.224 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.404 ' O ' ' HD2' ' A' ' 52' ' ' TYR . . . -59.89 -42.77 94.55 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.073 0.949 . . . . 0.0 112.251 178.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.402 HD11 HG22 ' A' ' 7' ' ' VAL . 3.6 mm? -55.84 -46.82 78.07 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.348 0.659 . . . . 0.0 110.213 175.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.1 mm-40 -56.82 -45.89 82.01 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 124.128 0.892 . . . . 0.0 110.529 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 47' ' ' THR . 67.2 mm-40 -59.09 -64.11 1.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 O-C-N 124.245 0.966 . . . . 0.0 111.281 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.404 ' HD2' ' O ' ' A' ' 48' ' ' ALA . 83.1 m-85 -66.96 -37.46 84.3 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.653 0.781 . . . . 0.0 112.719 -169.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.403 ' HB2' ' CE1' ' A' ' 55' ' ' PHE . 37.6 m-85 -91.65 -6.05 52.82 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 119.35 -0.357 . . . . 0.0 111.797 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 63.11 34.63 13.53 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.298 1.039 . . . . 0.0 111.841 169.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -135.14 -171.98 2.94 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.407 -175.098 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.8 t -135.66 126.21 26.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 122.42 0.288 . . . . 0.0 110.481 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.3 t -77.53 132.93 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.447 ' O ' HG13 ' A' ' 62' ' ' ILE . 20.5 t70 -71.81 143.72 49.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.04 0.536 . . . . 0.0 110.52 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.7 -41.64 82.12 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.888 0.875 . . . . 0.0 112.1 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -75.56 1.4 14.42 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.918 0.887 . . . . 0.0 112.516 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.92 -11.09 8.99 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.696 0.398 . . . . 0.0 111.43 172.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 58' ' ' ASP . 50.9 mt -82.37 113.86 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.7 t -136.09 175.15 9.87 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.869 0.868 . . . . 0.0 109.216 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.55 -33.69 76.5 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 170.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -64.89 -21.36 66.8 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.59 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 58.3 m -68.11 -36.74 80.24 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.848 0.459 . . . . 0.0 110.356 177.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.598 ' HA ' HD21 ' A' ' 73' ' ' LEU . 87.2 m-85 -95.67 16.63 16.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.978 0.511 . . . . 0.0 112.305 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -61.88 -46.67 88.38 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.227 0.33 . . . . 0.0 110.88 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.0 p -139.48 163.44 32.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.958 0.903 . . . . 0.0 110.407 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.4 tp -64.93 -31.01 72.04 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.581 0.752 . . . . 0.0 110.909 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.67 -29.54 69.49 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.716 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.0 m -64.1 -52.94 56.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.996 0.519 . . . . 0.0 110.3 174.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.598 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -59.3 -45.36 91.49 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 123.316 0.385 . . . . 0.0 110.811 177.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.37 87.06 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.195 0.934 . . . . 0.0 111.094 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -61.05 -53.46 56.92 Favored 'General case' 0 C--N 1.352 0.674 0 O-C-N 123.744 0.652 . . . . 0.0 109.809 178.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.482 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.2 m-85 -55.29 -52.65 62.75 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.152 0.908 . . . . 0.0 111.586 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.4 m -65.27 -32.14 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 123.355 0.409 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.34 -18.65 59.94 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.607 0.363 . . . . 0.0 111.731 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -80.29 -37.86 31.91 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.314 0.506 . . . . 0.0 109.662 171.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.6 mmmt -62.57 -58.32 7.99 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.095 0.958 . . . . 0.0 111.765 -176.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.02 -14.91 62.51 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.105 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.9 m -91.42 -31.2 16.11 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.932 0.493 . . . . 0.0 111.624 176.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 123.683 0.793 . . . . 0.0 109.119 -177.621 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.439 H422 HD11 ' A' ' 46' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.106 0.479 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -96.09 -55.04 3.09 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -70.85 -10.17 59.04 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 114.226 -1.352 . . . . 0.0 114.125 -165.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.0 -34.64 43.63 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.64 -34.87 67.6 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 120.825 0.345 . . . . 0.0 110.487 -175.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.71 -30.6 56.74 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.63 0.772 . . . . 0.0 110.71 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 95.5 t -67.02 -47.93 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -72.64 -26.0 61.49 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 122.662 0.385 . . . . 0.0 110.717 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.45 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.7 t30 -62.25 -47.55 83.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.158 0.583 . . . . 0.0 109.577 171.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.86 -47.44 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.979 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.6 mt -61.63 -38.83 89.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.237 0.615 . . . . 0.0 110.534 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.568 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.84 -19.69 78.3 Favored Glycine 0 C--N 1.344 1.015 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.815 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -84.28 -52.06 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.404 0.682 . . . . 0.0 110.975 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.5 t -69.72 -49.28 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.906 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.581 HD11 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -90.89 -6.51 54.07 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.144 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 64.61 65.62 0.63 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.126 0.97 . . . . 0.0 111.298 174.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.568 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 8.8 mp -85.75 -38.81 17.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.62 0.768 . . . . 0.0 110.799 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.68 -90.38 0.56 Allowed Glycine 0 C--N 1.35 1.322 0 O-C-N 123.31 0.381 . . . . 0.0 112.652 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.31 -19.92 16.81 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.903 0.881 . . . . 0.0 110.454 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -64.87 -31.95 73.43 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.459 0.704 . . . . 0.0 109.801 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 38.8 pttt -68.97 -32.88 72.78 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.793 0.437 . . . . 0.0 110.765 174.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -79.84 -29.75 40.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.171 0.589 . . . . 0.0 110.659 -173.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 t -81.63 -16.28 51.95 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.943 -177.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 pp -95.54 155.92 16.54 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.72 0.295 . . . . 0.0 110.867 -176.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.5 p -117.65 -172.35 2.22 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.263 1.025 . . . . 0.0 111.086 -175.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.21 75.39 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.345 0.658 . . . . 0.0 111.779 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -80.19 3.84 19.41 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.546 0.738 . . . . 0.0 112.266 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.2 t -75.38 136.65 40.77 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.691 0.396 . . . . 0.0 110.408 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.03 147.57 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.7 mt -108.26 -67.78 0.95 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 122.243 -0.286 . . . . 0.0 110.365 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.4 mt -56.73 116.33 3.09 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.812 0.445 . . . . 0.0 111.07 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.66 -23.43 19.64 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-N 115.331 -0.849 . . . . 0.0 113.807 176.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -77.2 -55.85 5.07 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 170.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 24.8 mm -76.52 118.08 69.04 Favored Pre-proline 0 C--O 1.241 0.634 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 176.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.48 -4.38 14.96 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.541 2.161 . . . . 0.0 112.517 -173.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.535 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 46.7 mm-40 -105.98 -15.85 14.79 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.972 0.909 . . . . 0.0 111.157 -175.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.0 tp -80.36 87.98 5.59 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 110.112 -175.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -99.62 -171.02 1.98 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.934 0.893 . . . . 0.0 111.201 174.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 42' ' ' VAL . 78.0 p -66.12 -53.05 42.69 Favored 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.454 1.101 . . . . 0.0 112.096 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -59.64 -30.52 68.79 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.709 0.766 . . . . 0.0 110.578 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.581 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -69.14 -26.91 65.12 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.634 174.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 39' ' ' SER . 2.2 m -65.8 -38.34 81.99 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.553 HG22 H382 ' A' ' 84' ' ' PNS . 7.5 t -62.61 -47.05 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 CA-C-O 121.259 0.552 . . . . 0.0 110.041 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -56.67 -51.47 68.65 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.797 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.6 m -68.26 -35.91 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.401 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.553 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -62.31 -45.77 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 54.3 m -57.87 -46.14 85.3 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 124.064 0.853 . . . . 0.0 110.595 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.0 -37.08 86.12 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -57.89 -50.67 72.54 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.236 0.614 . . . . 0.0 109.661 172.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.8 mm-40 -50.55 -51.21 50.02 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.61 1.164 . . . . 0.0 110.78 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' THR . 12.5 mm-40 -65.58 -53.49 41.08 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.454 -174.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -65.66 -46.24 79.91 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.51 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 2.9 m-85 -91.52 -13.8 31.48 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.628 -175.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 65.65 39.96 4.66 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.448 1.099 . . . . 0.0 111.418 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.51 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -131.94 179.36 6.13 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.686 0.794 . . . . 0.0 110.085 -177.108 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.9 t -130.53 112.22 12.99 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.988 0.18 . . . . 0.0 111.25 175.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.479 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.3 t -70.36 114.08 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.494 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.5 t70 -69.03 147.24 51.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.398 0.679 . . . . 0.0 110.854 -168.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.041 0.536 . . . . 0.0 112.408 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.92 -7.97 39.9 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.788 0.835 . . . . 0.0 113.233 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -115.02 -11.66 12.09 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.987 0.515 . . . . 0.0 111.825 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 58' ' ' ASP . 51.9 mt -88.51 125.51 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 120.737 0.303 . . . . 0.0 110.221 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.7 t -143.49 176.95 8.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.784 1.234 . . . . 0.0 108.948 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.99 -32.16 73.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.692 0.758 . . . . 0.0 109.38 167.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -69.2 -16.31 63.58 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 114.598 -1.183 . . . . 0.0 111.485 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 88.5 m -74.85 -39.2 61.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.405 0.682 . . . . 0.0 109.699 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.558 ' HA ' HD21 ' A' ' 73' ' ' LEU . 96.4 m-85 -93.96 17.29 12.52 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.848 0.859 . . . . 0.0 112.751 -176.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.08 -46.58 83.66 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 122.135 0.174 . . . . 0.0 110.688 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.1 p -138.35 161.11 37.77 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.44 0.696 . . . . 0.0 111.301 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.6 tp -57.75 -42.66 84.4 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.0 0.92 . . . . 0.0 110.816 175.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.62 -31.08 78.67 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.497 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -63.09 -53.59 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.968 0.507 . . . . 0.0 110.401 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.558 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.9 mm? -57.57 -42.58 83.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 123.4 0.438 . . . . 0.0 110.119 177.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.558 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.45 -42.45 98.79 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.43 -177.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -63.48 -48.29 78.26 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.098 0.559 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.531 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 37.2 m-85 -53.59 -54.6 35.27 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 123.733 0.646 . . . . 0.0 110.26 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.51 -25.85 34.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.109 0.563 . . . . 0.0 112.372 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 62.8 mm-40 -56.97 -51.45 69.17 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 169.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -67.3 -30.36 70.19 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.835 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.7 mmmt -64.63 -56.88 11.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.613 0.765 . . . . 0.0 112.226 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.2 -13.37 62.37 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.333 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.6 m -67.2 -38.68 85.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.859 0.463 . . . . 0.0 110.638 169.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 58.1 m80 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 123.271 0.628 . . . . 0.0 110.196 179.081 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.553 H382 HG22 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.414 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 120.861 0.362 . . . . 0.0 110.173 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.46 HE21 ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -99.23 -37.55 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.267 1.027 . . . . 0.0 110.467 177.076 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -70.96 -22.01 62.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -168.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -51.9 -31.74 29.65 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.032 0.933 . . . . 0.0 113.138 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' HG3' ' HE ' ' A' ' 8' ' ' ARG . 37.3 tt0 -75.12 -40.31 59.94 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 122.87 0.468 . . . . 0.0 111.25 -175.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.65 -28.61 64.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.992 0.517 . . . . 0.0 111.03 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.472 HG22 HD11 ' A' ' 49' ' ' LEU . 90.0 t -66.9 -49.24 75.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 41.8 ptt180 -71.03 -25.12 62.52 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.543 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 39.2 t30 -61.85 -49.32 76.76 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 123.335 0.654 . . . . 0.0 109.318 173.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.0 mt -60.54 -51.44 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.633 177.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.9 -34.24 77.69 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.224 0.21 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.587 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -72.4 -21.46 79.4 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-O 120.196 -0.224 . . . . 0.0 113.262 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.02 -57.14 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.4 0.68 . . . . 0.0 110.176 176.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 97.1 t -71.11 -47.38 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.741 1.216 . . . . 0.0 110.534 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.43 HD11 HD13 ' A' ' 37' ' ' LEU . 44.1 mt -83.46 -6.5 59.47 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.553 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 63.41 59.91 1.19 Allowed 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.58 1.152 . . . . 0.0 110.916 172.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.7 mp -89.65 -29.61 18.69 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.45 173.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.0 -89.88 0.21 Allowed Glycine 0 C--N 1.351 1.406 0 O-C-N 123.978 0.799 . . . . 0.0 112.31 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -101.17 -18.94 15.95 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.928 0.891 . . . . 0.0 110.857 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.86 -26.93 69.01 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.233 0.613 . . . . 0.0 111.095 -177.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.1 pttt -62.87 -34.91 78.36 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 123.246 0.618 . . . . 0.0 111.313 173.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -69.7 -29.1 66.43 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.386 1.074 . . . . 0.0 110.995 -176.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -93.26 -6.57 47.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -174.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -99.34 153.53 18.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 176.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.2 p -112.9 -176.07 2.81 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 111.184 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.95 -50.24 74.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.796 0.838 . . . . 0.0 110.668 173.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.1 m -71.54 -12.48 61.39 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.205 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -69.75 140.93 53.5 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 123.311 0.644 . . . . 0.0 110.168 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 63.6 t -79.37 152.21 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.364 1.066 . . . . 0.0 109.848 -176.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -114.28 -65.74 1.16 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.437 0.695 . . . . 0.0 109.862 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.1 mt -60.56 111.71 1.7 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.05 0.452 . . . . 0.0 110.703 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 103.03 -30.53 10.23 Favored Glycine 0 C--N 1.333 0.416 0 CA-C-N 115.061 -0.972 . . . . 0.0 112.79 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -79.54 -53.61 6.7 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.005 0.431 . . . . 0.0 110.058 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.441 HG22 ' H ' ' A' ' 36' ' ' GLU . 26.8 mm -87.29 120.82 71.45 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.72 -14.83 33.36 Favored 'Trans proline' 0 C--N 1.372 1.765 0 C-N-CA 122.39 2.06 . . . . 0.0 112.22 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.441 ' H ' HG22 ' A' ' 34' ' ' ILE . 19.6 mm-40 -85.83 -18.23 33.47 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 -174.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.43 HD13 HD11 ' A' ' 15' ' ' LEU . 40.2 tp -83.28 80.18 9.16 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 122.036 0.922 . . . . 0.0 110.272 -175.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -93.8 177.31 6.04 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.976 1.71 . . . . 0.0 109.681 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.711 ' HB3' H282 ' A' ' 84' ' ' PNS . 3.6 m -44.34 -64.11 0.75 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.827 1.251 . . . . 0.0 113.35 170.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.8 mmt -65.92 -26.83 67.78 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 121.512 -0.742 . . . . 0.0 111.236 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.18 -38.32 87.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.286 175.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 39' ' ' SER . 15.1 m -67.07 -35.06 73.52 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 176.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 t -62.17 -48.49 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 121.688 0.756 . . . . 0.0 110.177 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -59.62 -46.36 89.2 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 113.656 -1.611 . . . . 0.0 112.475 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.7 m -73.67 -30.86 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-O 118.972 -0.537 . . . . 0.0 112.127 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.455 HD13 HD13 ' A' ' 62' ' ' ILE . 96.4 mt -63.41 -48.77 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.7 m -55.84 -47.01 77.99 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.421 1.076 . . . . 0.0 110.153 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 -40.67 97.3 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.864 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD11 HG22 ' A' ' 7' ' ' VAL . 2.1 mm? -56.16 -49.91 72.63 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 121.284 0.564 . . . . 0.0 109.858 175.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -63.53 -38.67 92.0 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.594 -1.185 . . . . 0.0 112.249 -178.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -66.77 -54.57 21.34 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.406 0.682 . . . . 0.0 111.072 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -57.63 -57.6 12.01 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.788 0.835 . . . . 0.0 111.325 -177.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -82.55 -15.01 53.9 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.204 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 64.0 58.84 1.15 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.854 0.862 . . . . 0.0 111.427 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.472 ' CE2' HG22 ' A' ' 57' ' ' VAL . 8.9 p90 -142.95 -177.69 5.46 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.311 173.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.3 m -131.0 121.19 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.882 0.473 . . . . 0.0 110.311 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.472 HG22 ' CE2' ' A' ' 55' ' ' PHE . 2.1 t -77.69 127.31 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 29.4 t70 -89.83 153.75 20.42 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 122.799 0.44 . . . . 0.0 110.651 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -58.41 -34.29 70.6 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.043 0.937 . . . . 0.0 113.223 -176.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -59.75 -33.76 72.08 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.837 0.855 . . . . 0.0 112.156 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.0 pt-20 -97.99 -15.86 19.91 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.462 0.705 . . . . 0.0 110.822 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.455 HD13 HD13 ' A' ' 46' ' ' ILE . 38.4 mt -83.84 119.7 33.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 123.09 0.556 . . . . 0.0 111.061 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 82.9 p -155.29 -172.0 4.01 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.055 0.942 . . . . 0.0 109.378 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.48 -29.72 69.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.058 0.456 . . . . 0.0 110.38 171.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -67.94 -13.44 62.16 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.832 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.1 m -79.26 -41.47 28.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 0.0 110.105 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.466 ' HA ' HD21 ' A' ' 73' ' ' LEU . 78.6 m-85 -99.31 15.53 25.91 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.94 -49.6 76.8 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 123.055 0.222 . . . . 0.0 110.904 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 74.5 p -138.14 164.29 29.53 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.534 0.734 . . . . 0.0 110.515 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 tp -62.82 -34.5 77.44 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.205 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.02 -31.91 79.29 Favored Glycine 0 C--N 1.341 0.85 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.399 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -62.57 -53.01 61.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.164 0.586 . . . . 0.0 110.103 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.466 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.48 -41.91 81.63 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 123.357 0.41 . . . . 0.0 110.612 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.558 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.22 -44.95 92.29 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 124.048 0.843 . . . . 0.0 110.891 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.84 -54.95 41.08 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.195 0.998 . . . . 0.0 110.118 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 66.2 m-85 -53.83 -55.87 22.7 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.013 0.82 . . . . 0.0 110.753 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 19.6 m -66.48 -25.98 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 79.3 mm-40 -59.17 -52.67 64.7 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -60.8 -38.99 87.23 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.102 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.515 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -67.93 -52.43 36.23 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.598 0.759 . . . . 0.0 111.606 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.37 -17.96 62.39 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.989 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -78.59 -34.97 46.4 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.819 0.448 . . . . 0.0 111.059 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m80 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 123.38 0.672 . . . . 0.0 110.039 -175.571 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.711 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.99 -21.52 15.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.414 0.686 . . . . 0.0 111.402 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -90.72 -14.84 31.36 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 118.209 -0.901 . . . . 0.0 113.086 -174.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.52 -28.22 43.77 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 118.785 0.721 . . . . 0.0 112.203 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 39.3 tt0 -67.97 -46.84 70.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.764 0.825 . . . . 0.0 110.601 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.32 -32.61 70.43 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.426 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 89.2 t -66.26 -48.38 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 122.864 0.465 . . . . 0.0 109.788 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 5' ' ' GLU . 37.1 ptt180 -69.08 -26.76 65.1 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 123.533 0.521 . . . . 0.0 110.144 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -61.42 -51.39 68.92 Favored 'General case' 0 C--N 1.351 0.644 0 C-N-CA 123.532 0.733 . . . . 0.0 109.506 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.5 mt -62.73 -49.12 84.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.105 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.84 -45.9 87.44 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.06 0.544 . . . . 0.0 111.047 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.493 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -69.93 -18.42 74.4 Favored Glycine 0 C--N 1.337 0.605 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.442 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -81.14 -53.22 6.57 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 117.293 0.546 . . . . 0.0 110.228 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.65 -49.8 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 124.066 0.946 . . . . 0.0 111.141 -173.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.531 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -82.76 -7.4 59.66 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.892 0.477 . . . . 0.0 111.159 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 t30 62.23 64.03 1.01 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.668 1.187 . . . . 0.0 111.644 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.555 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 9.6 mp -88.66 -31.43 18.52 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.91 170.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.93 -99.62 0.5 Allowed Glycine 0 C--N 1.352 1.431 0 O-C-N 123.552 0.533 . . . . 0.0 113.617 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.15 -23.18 35.73 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.056 0.943 . . . . 0.0 110.689 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.555 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -67.56 -30.21 69.78 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 122.944 0.498 . . . . 0.0 111.234 -175.384 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.493 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.1 pttt -65.15 -26.21 68.08 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 120.689 0.281 . . . . 0.0 111.341 177.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -79.5 -33.74 41.9 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 123.265 0.626 . . . . 0.0 110.691 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 t -83.2 -8.59 59.46 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -173.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.4 pp -96.23 166.78 11.57 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 120.969 0.414 . . . . 0.0 110.524 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 73.3 p -115.1 -178.91 3.48 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.113 0.965 . . . . 0.0 110.335 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.89 -14.94 57.46 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.139 0.576 . . . . 0.0 112.209 174.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.4 t -90.9 8.25 35.99 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.045 0.538 . . . . 0.0 111.587 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 94.1 p -78.87 121.2 24.54 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.62 0.368 . . . . 0.0 110.15 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.02 145.71 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.458 ' HA ' HG12 ' A' ' 34' ' ' ILE . 55.2 mt -101.69 -70.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 122.071 -0.393 . . . . 0.0 109.954 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.6 mt -57.94 114.95 2.56 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 122.954 0.501 . . . . 0.0 111.393 178.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.05 -38.1 3.22 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.121 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -75.92 -51.99 11.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.906 0.482 . . . . 0.0 109.913 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.458 HG12 ' HA ' ' A' ' 30' ' ' LEU . 19.6 mm -79.08 112.23 26.24 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 175.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.34 2.27 8.62 Favored 'Trans proline' 0 C--N 1.369 1.652 0 C-N-CA 122.764 2.309 . . . . 0.0 112.113 -177.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 23.4 mm-40 -97.12 -19.41 18.69 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 123.802 0.841 . . . . 0.0 109.688 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.34 96.86 6.79 Favored 'General case' 0 C--N 1.352 0.697 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -90.77 173.87 7.78 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.801 1.24 . . . . 0.0 109.615 172.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.615 ' O ' HG22 ' A' ' 42' ' ' VAL . 86.6 p -59.21 -49.13 79.01 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.508 0.723 . . . . 0.0 111.081 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.3 mmt -60.51 -31.19 70.26 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.9 -0.5 . . . . 0.0 110.724 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.531 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -69.57 -29.01 66.48 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.346 176.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 39' ' ' SER . 2.3 m -63.8 -37.2 79.09 Favored 'Isoleucine or valine' 0 C--N 1.372 1.584 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.593 HG21 H312 ' A' ' 84' ' ' PNS . 9.8 t -66.92 -47.46 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.174 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.59 -42.78 88.84 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 114.031 -1.441 . . . . 0.0 112.173 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -75.7 -31.01 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.654 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.578 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.8 mt -59.79 -54.43 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 172.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 37.7 m -51.37 -49.2 61.96 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 124.673 1.233 . . . . 0.0 110.868 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.78 -43.78 98.18 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.014 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -55.59 -47.97 75.61 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.144 0.578 . . . . 0.0 110.333 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -59.4 -43.83 92.91 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.983 0.913 . . . . 0.0 111.241 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' THR . 33.2 mm-40 -65.12 -59.12 4.46 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.597 0.759 . . . . 0.0 111.097 -177.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -67.34 -44.85 78.06 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.554 0.741 . . . . 0.0 112.288 -171.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -82.56 -21.14 35.42 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 119.402 -0.332 . . . . 0.0 111.309 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.7 t70 64.03 64.1 0.77 Allowed 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.261 1.024 . . . . 0.0 110.615 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.02 -174.3 4.93 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.7 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -130.49 119.96 23.41 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.217 0.607 . . . . 0.0 110.698 170.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.2 t -70.72 126.37 30.84 Favored 'Isoleucine or valine' 0 C--N 1.353 0.755 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 165.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.3 t70 -73.54 144.57 46.06 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 122.564 0.346 . . . . 0.0 110.848 -174.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -51.16 -42.66 60.95 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.067 0.947 . . . . 0.0 112.973 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.83 -19.91 63.45 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.798 0.839 . . . . 0.0 112.701 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.2 pt-20 -102.55 -7.4 21.88 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 122.82 0.448 . . . . 0.0 111.15 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 58' ' ' ASP . 75.4 mt -85.81 105.39 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.7 t -133.16 170.57 15.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.016 0.926 . . . . 0.0 109.599 174.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.72 -32.11 71.38 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 121.472 0.654 . . . . 0.0 109.996 170.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -71.74 -12.58 61.38 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.599 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.416 HG22 HD13 ' A' ' 73' ' ' LEU . 42.1 m -74.72 -42.18 58.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.577 ' HA ' HD21 ' A' ' 73' ' ' LEU . 92.2 m-85 -92.72 20.94 5.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.096 0.958 . . . . 0.0 112.31 -176.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.458 ' HG3' HG22 ' A' ' 69' ' ' THR . 7.6 pt-20 -65.14 -45.21 85.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.292 0.237 . . . . 0.0 110.633 176.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.458 HG22 ' HG3' ' A' ' 68' ' ' GLU . 11.5 t -150.13 158.53 44.25 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.064 0.546 . . . . 0.0 110.873 -179.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 tp -52.33 -40.34 61.8 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.547 1.139 . . . . 0.0 111.55 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.96 -41.82 96.52 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 114.607 -1.179 . . . . 0.0 111.794 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.425 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 50.5 m -60.1 -50.29 74.3 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.001 0.52 . . . . 0.0 111.035 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.577 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -58.06 -40.17 80.31 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 122.604 0.361 . . . . 0.0 110.395 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.555 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.92 -48.64 80.9 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.308 1.005 . . . . 0.0 110.632 178.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.12 -45.59 87.03 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 124.042 0.937 . . . . 0.0 111.002 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.481 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.5 m-85 -56.71 -57.35 12.79 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.294 177.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.7 m -67.6 -23.11 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.3 mm-40 -57.39 -51.28 70.06 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.0 m170 -63.48 -51.84 63.88 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.312 -176.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.57 -48.49 79.21 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 0.0 112.451 -171.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -78.1 -16.72 57.74 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.155 -178.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.5 m -89.42 -8.67 52.56 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.82 0.448 . . . . 0.0 111.493 172.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 173.623 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.638 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mpp? . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 121.437 0.637 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.472 ' HA ' HE21 ' A' ' 2' ' ' GLN . 0.0 OUTLIER -95.1 -46.59 6.73 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.152 171.279 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -74.83 -17.72 60.56 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 113.549 -1.659 . . . . 0.0 113.507 -164.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.24 -37.72 37.06 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.991 0.916 . . . . 0.0 112.487 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -75.17 -41.1 58.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.712 -174.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.54 66.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.367 0.667 . . . . 0.0 111.414 174.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.7 t -70.46 -50.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.082 0.553 . . . . 0.0 109.536 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -67.08 -27.41 67.34 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.32 -58.56 6.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.011 0.924 . . . . 0.0 109.727 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.405 ' O ' HG23 ' A' ' 14' ' ' VAL . 95.3 mt -61.28 -49.77 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.951 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.12 -41.78 89.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.308 0.643 . . . . 0.0 111.126 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.527 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.61 -19.99 79.69 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 121.556 -0.354 . . . . 0.0 113.42 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -75.73 -48.64 21.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.949 0.5 . . . . 0.0 110.446 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 10' ' ' ILE . 57.3 t -67.47 -48.63 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 123.523 0.729 . . . . 0.0 110.38 -177.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.511 ' HB2' HD13 ' A' ' 17' ' ' LEU . 44.2 mt -84.5 0.04 51.25 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.227 -177.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 66.76 24.84 9.83 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.366 1.066 . . . . 0.0 111.507 170.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.511 HD13 ' HB2' ' A' ' 15' ' ' LEU . 9.6 mp -60.11 -41.31 92.3 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.222 0.609 . . . . 0.0 110.706 174.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.16 -81.68 0.03 OUTLIER Glycine 0 C--N 1.354 1.546 0 O-C-N 124.196 0.935 . . . . 0.0 114.089 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -87.47 -35.83 18.02 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.026 0.93 . . . . 0.0 110.252 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.09 -28.29 69.98 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.123 0.969 . . . . 0.0 110.904 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.527 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 54.9 pttt -70.33 -31.99 69.53 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.806 0.442 . . . . 0.0 111.864 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -80.02 -31.5 39.6 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.102 0.561 . . . . 0.0 110.726 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.1 t -85.65 -5.88 59.21 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.207 0.603 . . . . 0.0 112.45 -175.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -98.07 155.99 16.87 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.236 0.471 . . . . 0.0 110.084 176.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.8 p -112.94 -175.64 2.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.619 0.767 . . . . 0.0 110.921 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -35.77 76.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.273 0.629 . . . . 0.0 110.944 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.6 m -75.95 -15.8 60.11 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.368 -0.833 . . . . 0.0 112.242 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.9 p -67.82 140.63 56.61 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.859 0.299 . . . . 0.0 110.825 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.7 t -84.26 143.06 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 123.782 0.833 . . . . 0.0 109.341 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.428 ' HA ' HG12 ' A' ' 34' ' ' ILE . 49.2 mt -110.35 -70.27 0.82 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.828 0.451 . . . . 0.0 109.873 178.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.01 112.52 1.22 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.393 1.077 . . . . 0.0 110.699 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 -40.47 2.48 Favored Glycine 0 C--N 1.345 1.081 0 O-C-N 123.541 0.526 . . . . 0.0 112.745 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -78.14 -59.07 2.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.262 0.625 . . . . 0.0 110.475 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.456 HG22 ' H ' ' A' ' 36' ' ' GLU . 31.9 mm -76.26 120.28 80.96 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.32 -13.38 35.69 Favored 'Trans proline' 0 C--N 1.37 1.699 0 C-N-CA 122.726 2.284 . . . . 0.0 112.441 -177.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.456 ' H ' HG22 ' A' ' 34' ' ' ILE . 21.8 mm-40 -86.75 -13.92 43.87 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.53 0.732 . . . . 0.0 111.27 -177.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.41 81.7 5.64 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.423 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 17.5 t70 -96.04 170.88 8.97 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.65 1.58 . . . . 0.0 109.92 178.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.725 ' HB3' H282 ' A' ' 84' ' ' PNS . 6.1 m -46.56 -67.81 0.25 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.712 1.205 . . . . 0.0 113.019 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.0 mmm -66.13 -24.07 66.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.801 -0.562 . . . . 0.0 111.501 -177.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.423 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -65.42 -37.06 85.82 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 124.069 0.856 . . . . 0.0 112.251 174.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.627 HG22 ' O ' ' A' ' 39' ' ' SER . 7.7 m -68.7 -37.61 77.77 Favored 'Isoleucine or valine' 0 C--N 1.367 1.347 0 CA-C-N 118.445 0.566 . . . . 0.0 109.776 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -61.18 -45.29 98.88 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.592 0.711 . . . . 0.0 109.374 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.4 -50.14 74.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 113.605 -1.634 . . . . 0.0 113.085 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.7 m -71.82 -30.51 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.619 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -63.48 -50.59 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.3 m -53.24 -48.68 68.01 Favored 'General case' 0 C--N 1.351 0.656 0 O-C-N 124.421 1.076 . . . . 0.0 110.929 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.41 -43.74 98.1 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.115 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -57.13 -46.5 82.63 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.463 0.705 . . . . 0.0 110.59 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.88 -44.64 91.16 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.034 0.934 . . . . 0.0 111.222 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 47' ' ' THR . 37.6 mm-40 -59.31 -61.34 2.7 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.63 0.772 . . . . 0.0 111.353 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -67.3 -51.56 51.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.874 -171.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 1.6 m-30 -75.2 -16.26 60.5 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.522 0.329 . . . . 0.0 111.551 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.0 t70 68.12 66.73 0.34 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.268 1.027 . . . . 0.0 110.63 175.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.481 ' CE2' HG22 ' A' ' 57' ' ' VAL . 7.7 p90 -157.01 -170.28 3.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.015 172.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.88 138.66 45.71 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 167.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.481 HG22 ' CE2' ' A' ' 55' ' ' PHE . 2.9 t -89.69 122.69 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 176.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' ILE . 18.0 t70 -87.93 153.79 21.02 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.674 0.79 . . . . 0.0 111.281 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.67 -36.9 67.61 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.548 1.139 . . . . 0.0 112.365 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.35 -33.55 76.23 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.228 1.011 . . . . 0.0 111.844 -173.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -96.87 -20.68 17.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.941 0.496 . . . . 0.0 110.918 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' ASP . 53.7 mt -74.76 124.51 32.61 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 174.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.5 t -146.13 -178.7 6.27 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.39 1.076 . . . . 0.0 108.474 165.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.589 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -64.67 -32.41 74.06 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.401 0.619 . . . . 0.0 109.574 168.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -65.94 -12.28 53.63 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.837 178.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 91.6 m -72.9 -38.17 67.0 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.009 0.523 . . . . 0.0 110.489 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.524 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.6 m-85 -97.75 7.05 47.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.16 -47.85 77.44 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.376 0.422 . . . . 0.0 111.232 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.6 p -135.8 166.33 23.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.964 0.506 . . . . 0.0 110.868 173.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.9 tp -59.57 -38.05 80.11 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.072 174.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.1 -35.08 90.96 Favored Glycine 0 C--N 1.343 0.959 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.87 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -62.28 -53.08 60.32 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.012 0.525 . . . . 0.0 110.574 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.524 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -56.43 -43.48 79.46 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.508 0.505 . . . . 0.0 110.071 176.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.58 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.92 -48.13 82.57 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 124.589 1.18 . . . . 0.0 111.667 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 75' ' ' LEU . 2.4 mm? -66.96 -39.03 87.15 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.423 0.452 . . . . 0.0 110.94 -179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.495 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 24.5 m-85 -57.68 -54.72 43.66 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 176.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.44 -24.38 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.099 0.56 . . . . 0.0 112.051 -178.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.6 mm-40 -57.47 -56.01 27.42 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -60.19 -34.94 74.32 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.546 -174.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 30.9 mmmt -63.85 -56.71 13.33 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.344 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.456 HD22 ' HB2' ' A' ' 80' ' ' LYS . 3.1 mm? -84.22 -13.26 53.15 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -173.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.7 m -102.55 -14.97 16.57 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -175.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.5 p-80 . . . . . 0 N--CA 1.493 1.702 0 CA-C-N 119.02 0.827 . . . . 0.0 110.61 -177.132 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.725 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.453 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.409 HE21 ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -99.11 -36.22 9.76 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.035 0.934 . . . . 0.0 110.799 177.298 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.83 -17.57 61.05 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -169.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -51.99 -33.04 36.42 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 123.809 0.844 . . . . 0.0 112.581 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 -41.78 63.96 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.205 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.5 -28.95 65.36 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.917 0.487 . . . . 0.0 111.053 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.3 t -67.54 -50.55 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 122.994 0.517 . . . . 0.0 109.927 176.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -67.52 -28.62 67.97 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -60.26 -52.89 63.37 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 123.966 0.791 . . . . 0.0 109.749 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 49' ' ' LEU . 85.7 mt -62.92 -55.33 24.3 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 O-C-N 124.219 0.949 . . . . 0.0 111.492 -178.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.64 -34.65 78.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.742 0.417 . . . . 0.0 111.495 -175.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.478 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -78.91 -20.05 71.46 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-O 119.989 -0.34 . . . . 0.0 113.689 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.18 -48.01 25.63 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.033 0.533 . . . . 0.0 109.705 173.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.434 HG13 ' ND2' ' A' ' 44' ' ' ASN . 71.2 t -70.17 -49.77 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.466 1.106 . . . . 0.0 110.929 -176.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -78.21 -9.26 59.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.427 0.691 . . . . 0.0 111.255 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 67.02 44.52 1.94 Allowed 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.543 1.137 . . . . 0.0 111.401 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 7.0 mp -72.29 -35.36 68.66 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.54 1.136 . . . . 0.0 110.68 173.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.24 -91.39 0.37 Allowed Glycine 0 C--N 1.346 1.122 0 CA-C-N 115.727 -0.67 . . . . 0.0 113.494 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -97.06 -21.02 17.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.787 0.835 . . . . 0.0 110.754 -177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -61.9 -34.25 75.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.392 0.677 . . . . 0.0 109.893 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 56.9 pttt -68.78 -29.84 68.3 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.224 0.61 . . . . 0.0 111.579 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -75.8 -40.74 54.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.164 0.586 . . . . 0.0 110.313 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -85.87 13.32 7.57 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.215 0.606 . . . . 0.0 112.05 -173.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 28' ' ' SER . 3.6 pp -113.36 163.09 15.29 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 122.011 -0.431 . . . . 0.0 111.206 172.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.9 p -122.81 -173.17 2.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.478 1.111 . . . . 0.0 110.251 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.03 65.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.316 0.646 . . . . 0.0 112.719 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.5 m -86.79 0.48 54.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.198 0.599 . . . . 0.0 112.602 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.436 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 97.2 p -73.26 125.68 28.34 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.588 0.355 . . . . 0.0 110.751 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.0 t -76.83 136.22 25.02 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.3 mt -108.6 -69.74 0.84 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.532 0.333 . . . . 0.0 110.229 -175.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.52 117.02 5.64 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.45 -33.12 6.26 Favored Glycine 0 C--N 1.342 0.91 0 CA-C-N 115.855 -0.612 . . . . 0.0 113.151 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -90.54 -44.73 9.38 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.084 0.554 . . . . 0.0 110.983 -175.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.501 HG12 ' HA ' ' A' ' 30' ' ' LEU . 33.7 mm -79.87 120.3 79.46 Favored Pre-proline 0 CA--C 1.544 0.717 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -70.72 -13.77 32.54 Favored 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 122.847 2.364 . . . . 0.0 112.927 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.433 ' H ' HG22 ' A' ' 34' ' ' ILE . 8.5 mm-40 -94.11 -11.65 30.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.363 0.665 . . . . 0.0 111.091 -174.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 tt -82.66 88.9 6.69 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' HG13 ' A' ' 42' ' ' VAL . 25.6 t70 -101.63 174.03 6.15 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.309 1.443 . . . . 0.0 108.932 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.652 ' HB3' H282 ' A' ' 84' ' ' PNS . 6.2 m -44.78 -65.33 0.54 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.796 1.238 . . . . 0.0 113.45 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 90.7 mmm -71.31 -16.68 62.46 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.606 -0.684 . . . . 0.0 111.654 -175.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.82 -33.85 71.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.319 0.648 . . . . 0.0 111.539 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 39' ' ' SER . 2.7 m -68.19 -39.4 81.14 Favored 'Isoleucine or valine' 0 C--N 1.371 1.507 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.9 t -64.85 -43.32 96.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.534 0.683 . . . . 0.0 109.904 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.434 ' ND2' HG13 ' A' ' 14' ' ' VAL . 56.3 t30 -66.02 -39.55 90.32 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.91 -1.496 . . . . 0.0 112.287 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 m -70.38 -39.59 76.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.036 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 42' ' ' VAL . 92.9 mt -61.4 -43.1 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 CA-C-N 118.257 0.48 . . . . 0.0 110.045 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.468 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 87.8 m -58.86 -45.13 90.84 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.108 175.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.432 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -63.07 -36.75 84.63 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.642 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 10' ' ' ILE . 3.5 mm? -60.35 -40.08 89.45 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.496 0.718 . . . . 0.0 110.103 175.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -57.98 -51.02 71.39 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.005 0.816 . . . . 0.0 110.481 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 47' ' ' THR . 7.5 mm-40 -58.62 -45.1 89.95 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 124.161 0.913 . . . . 0.0 111.473 -173.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.432 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 17.3 m-85 -81.74 -55.98 4.28 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -172.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -83.82 -18.19 38.47 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.0 58.88 2.58 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.339 1.056 . . . . 0.0 111.384 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -129.29 -171.82 2.59 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.431 172.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.1 m -127.8 111.72 13.96 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.628 166.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.1 t -69.47 112.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.358 0.949 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 173.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 32.9 t70 -77.54 151.71 34.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.179 0.592 . . . . 0.0 111.217 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -60.16 -32.94 71.52 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.604 0.761 . . . . 0.0 112.433 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -71.48 -31.85 67.6 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.296 0.638 . . . . 0.0 111.823 -173.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -85.65 -20.54 29.28 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 122.744 0.418 . . . . 0.0 110.887 -178.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 68.1 mt -73.07 124.06 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.26 0.624 . . . . 0.0 111.039 177.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 86.2 p -147.91 175.99 10.52 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.193 0.997 . . . . 0.0 109.448 166.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.546 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -61.07 -36.14 78.84 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.636 0.731 . . . . 0.0 110.194 169.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -78.75 -8.63 58.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.114 -176.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -70.71 -37.63 73.57 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.628 ' HA ' HD21 ' A' ' 73' ' ' LEU . 55.2 m-85 -97.58 14.71 25.67 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.406 0.682 . . . . 0.0 112.72 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.69 -44.19 96.87 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 0.0 111.0 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 72' ' ' SER . 15.3 t -144.94 162.21 37.44 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.252 0.621 . . . . 0.0 110.428 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.77 -36.85 77.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.106 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.23 -33.86 87.31 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.96 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.407 ' H ' HG23 ' A' ' 69' ' ' THR . 74.4 m -64.67 -53.51 46.31 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 122.89 0.476 . . . . 0.0 110.662 177.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.628 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -59.01 -39.04 80.64 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.021 0.201 . . . . 0.0 110.477 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.564 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.03 -45.49 86.86 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 124.073 0.858 . . . . 0.0 110.383 176.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.76 -49.76 76.45 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.957 0.903 . . . . 0.0 110.893 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.448 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 72.9 m-85 -61.59 -48.14 82.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.596 0.358 . . . . 0.0 111.037 -178.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 18.2 m -70.17 -26.79 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.512 0.325 . . . . 0.0 111.627 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 77.6 mm-40 -59.37 -51.86 68.11 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -58.69 -37.6 76.43 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 124.097 0.873 . . . . 0.0 112.052 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.0 mmmt -59.76 -54.96 40.17 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.254 0.55 . . . . 0.0 110.853 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.07 -14.01 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.895 -176.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.3 m -90.15 -21.62 22.13 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.678 0.391 . . . . 0.0 111.567 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 . . . . . 0 N--CA 1.483 1.177 0 C-N-CA 123.318 0.647 . . . . 0.0 109.443 -177.829 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.652 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.32 -41.77 8.09 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.135 0.969 . . . . 0.0 108.432 178.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -82.77 -3.91 57.24 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 113.691 -1.595 . . . . 0.0 112.734 -168.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -52.14 -34.32 44.12 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.941 0.897 . . . . 0.0 112.434 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.79 -43.21 63.04 Favored 'General case' 0 C--N 1.352 0.686 0 O-C-N 123.579 0.549 . . . . 0.0 110.355 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.62 -31.96 73.27 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.571 0.348 . . . . 0.0 111.124 176.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 85.1 t -68.53 -46.51 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 122.821 0.448 . . . . 0.0 110.461 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -70.79 -23.12 62.33 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.673 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -63.95 -50.19 69.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.479 HG21 HD22 ' A' ' 49' ' ' LEU . 88.7 mt -61.39 -48.3 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.673 178.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -65.05 -36.81 85.53 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.052 0.541 . . . . 0.0 110.341 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.532 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -71.45 -21.05 78.69 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 115.54 -0.755 . . . . 0.0 113.67 175.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -85.85 -46.01 11.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.952 0.901 . . . . 0.0 111.225 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.7 t -76.86 -55.73 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 123.752 0.821 . . . . 0.0 110.385 -175.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.533 HD11 ' HB1' ' A' ' 41' ' ' ALA . 1.7 mm? -82.93 -9.52 59.26 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.858 -176.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 68.28 63.52 0.36 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.735 1.214 . . . . 0.0 110.796 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.532 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.0 mp -82.01 -36.93 27.3 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.586 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 62.94 -89.66 0.06 OUTLIER Glycine 0 C--N 1.356 1.688 0 O-C-N 123.632 0.583 . . . . 0.0 113.795 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.94 -40.57 22.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.785 0.834 . . . . 0.0 110.317 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -28.17 63.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.917 1.287 . . . . 0.0 112.298 -170.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.7 4.11 8.45 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -92.16 -46.98 7.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.91 0.484 . . . . 0.0 109.775 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.0 t -70.48 -29.09 65.54 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.87 -172.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 4.1 pp -84.16 157.42 21.68 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.84 0.456 . . . . 0.0 111.431 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.2 p -137.42 -162.68 1.32 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.357 1.463 . . . . 0.0 108.533 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.83 -23.07 51.04 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -174.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.8 m -77.67 -12.02 59.93 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.635 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 35.9 t -62.03 124.74 21.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.742 0.817 . . . . 0.0 111.349 -177.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 67.6 t -74.0 153.97 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 70.9 mt -120.97 -60.11 1.68 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.435 HD23 HD12 ' A' ' 37' ' ' LEU . 33.5 mt -56.73 110.94 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.142 0.577 . . . . 0.0 110.63 169.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.42 -32.56 6.13 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.269 -0.878 . . . . 0.0 113.181 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -76.86 -60.29 2.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.529 0.331 . . . . 0.0 110.18 -179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.519 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 25.1 mm -78.33 116.98 63.46 Favored Pre-proline 0 CA--C 1.542 0.659 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.15 -6.55 18.09 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.324 2.016 . . . . 0.0 112.297 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -97.9 -10.29 24.85 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.69 0.796 . . . . 0.0 111.144 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.519 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.8 tm? -79.0 82.81 5.15 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -177.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.425 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 32.0 t70 -101.79 174.34 6.0 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.417 1.487 . . . . 0.0 109.74 176.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.637 ' HB3' H282 ' A' ' 84' ' ' PNS . 0.5 OUTLIER -43.32 -60.52 1.67 Allowed 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.209 1.404 . . . . 0.0 112.715 166.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.9 mmt -60.83 -32.49 71.87 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 121.135 0.493 . . . . 0.0 110.822 -178.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.533 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -68.74 -29.33 67.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.648 176.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 39' ' ' SER . 3.3 m -66.96 -37.68 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.875 0.761 . . . . 0.0 109.171 174.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.458 HG22 H382 ' A' ' 84' ' ' PNS . 4.2 t -67.28 -44.64 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-O 121.543 0.687 . . . . 0.0 109.29 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -58.69 -49.5 77.36 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.059 -1.428 . . . . 0.0 112.532 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -70.35 -39.04 76.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.802 -175.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 89.2 mt -60.15 -46.26 94.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 88.4 m -57.0 -43.32 81.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 124.065 0.853 . . . . 0.0 110.611 174.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.406 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -69.6 -28.19 65.73 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.265 0.626 . . . . 0.0 112.15 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.531 HD12 HG11 ' A' ' 77' ' ' VAL . 3.6 mm? -61.95 -48.11 81.85 Favored 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -56.43 -42.83 78.72 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.005 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' THR . 47.3 mm-40 -60.17 -64.34 0.98 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.879 0.872 . . . . 0.0 111.571 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.447 ' HB2' HD11 ' A' ' 10' ' ' ILE . 48.3 m-85 -66.56 -45.78 78.24 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.838 0.711 . . . . 0.0 112.326 -171.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -83.94 -21.68 31.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 66.29 57.93 0.72 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.458 1.103 . . . . 0.0 111.025 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -140.58 179.48 6.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.157 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.1 t -126.44 114.89 18.77 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.1 p -72.48 145.77 11.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 C-N-CA 124.944 1.298 . . . . 0.0 110.918 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.467 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.1 t70 -87.01 142.22 28.09 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 174.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.4 -36.79 74.29 Favored 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -176.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -70.19 -15.98 63.01 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -171.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.9 pt-20 -86.91 -33.43 19.72 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.647 0.379 . . . . 0.0 110.34 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 42.9 mt -78.99 129.01 38.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.573 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.006 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 t -141.76 -177.68 5.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.957 1.303 . . . . 0.0 107.961 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.73 -27.41 67.6 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -64.84 -13.41 55.99 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.371 1.068 . . . . 0.0 111.659 174.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 89.1 m -76.03 -50.25 15.31 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 170.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.459 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 97.5 m-85 -84.2 8.76 14.71 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.2 pt-20 -60.04 -42.97 95.58 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 122.47 0.308 . . . . 0.0 110.907 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.52 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.0 t -150.82 162.53 40.56 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.418 0.628 . . . . 0.0 112.009 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.7 -37.78 82.82 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 114.506 -1.224 . . . . 0.0 110.754 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.94 -32.46 84.11 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.149 -0.932 . . . . 0.0 112.86 -177.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 54.9 m -70.17 -51.94 27.3 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.265 177.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.41 -46.62 62.98 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.234 0.54 . . . . 0.0 111.105 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -63.68 -39.18 93.69 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.203 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -47.34 83.02 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.953 0.901 . . . . 0.0 109.628 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.464 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 59.1 m-85 -61.78 -43.51 98.7 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.207 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.531 HG11 HD12 ' A' ' 49' ' ' LEU . 29.9 m -72.87 -23.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-O 119.007 -0.521 . . . . 0.0 112.228 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 65.0 mm-40 -56.19 -51.17 69.0 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 167.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 76' ' ' PHE . 90.6 m-70 -54.33 -49.56 69.44 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.286 0.991 . . . . 0.0 111.832 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 28.1 mmmt -68.18 -43.71 77.53 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -171.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.25 -14.9 52.24 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.699 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.2 m -107.97 -11.62 15.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.173 0.589 . . . . 0.0 112.55 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 . . . . . 0 C--O 1.25 1.128 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.668 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.637 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 tpt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.76 -36.49 79.07 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.801 0.84 . . . . 0.0 113.026 -166.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' ' 7' ' ' VAL . 2.6 m-70 -73.23 -11.56 60.56 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 118.187 -0.911 . . . . 0.0 112.282 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.24 -30.83 51.67 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 118.395 0.543 . . . . 0.0 110.879 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.19 -53.14 53.96 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 124.549 1.14 . . . . 0.0 110.528 -178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.435 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.26 -35.49 79.63 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.393 -0.822 . . . . 0.0 111.252 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -65.82 -51.74 58.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 O-C-N 123.433 0.458 . . . . 0.0 110.048 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 11' ' ' LEU . 40.9 ptt180 -68.8 -27.0 65.48 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.041 0.536 . . . . 0.0 110.29 -176.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.6 -48.98 79.36 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 123.96 0.788 . . . . 0.0 109.657 173.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.2 mt -63.15 -47.41 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 124.274 0.984 . . . . 0.0 110.932 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 8' ' ' ARG . 52.2 mt -60.3 -42.79 96.28 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.492 0.717 . . . . 0.0 111.025 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.458 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -77.33 -18.78 77.66 Favored Glycine 0 C--N 1.339 0.72 0 CA-C-N 115.742 -0.663 . . . . 0.0 113.202 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.1 -43.31 43.9 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.225 0.512 . . . . 0.0 109.693 174.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 10' ' ' ILE . 88.1 t -71.8 -60.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -83.05 -3.8 57.65 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.925 -1.034 . . . . 0.0 111.621 -170.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 66.61 55.97 0.76 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.792 1.237 . . . . 0.0 111.733 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -84.11 -29.25 26.91 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.673 0.789 . . . . 0.0 110.964 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.25 -99.54 1.32 Allowed Glycine 0 C--N 1.35 1.343 0 O-C-N 123.542 0.526 . . . . 0.0 112.52 177.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.15 -23.05 18.09 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.826 0.85 . . . . 0.0 110.389 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.518 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.24 -30.86 71.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 0.0 110.421 -175.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 60.0 pttt -62.8 -33.61 75.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.309 0.644 . . . . 0.0 111.806 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -88.71 -18.54 27.65 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.024 0.529 . . . . 0.0 111.315 -172.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.7 t -94.52 -1.53 53.25 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.049 0.54 . . . . 0.0 111.244 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.518 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -99.0 148.12 24.32 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 173.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.5 p -118.39 -171.95 2.18 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.528 0.731 . . . . 0.0 111.173 -170.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.06 -23.47 67.46 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.114 0.565 . . . . 0.0 112.458 178.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.1 t -88.01 -17.05 32.03 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.328 0.651 . . . . 0.0 111.753 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 24' ' ' LEU . 79.0 p -77.33 128.06 33.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.44 0.296 . . . . 0.0 110.214 -178.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.4 t -81.38 143.04 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 124.571 1.149 . . . . 0.0 109.772 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.569 ' HA ' HG12 ' A' ' 34' ' ' ILE . 64.4 mt -102.33 -67.81 0.86 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.397 0.679 . . . . 0.0 110.236 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.601 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.2 tt -57.46 115.74 2.92 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.88 0.872 . . . . 0.0 111.442 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.59 -22.54 7.5 Favored Glycine 0 C--N 1.353 1.479 0 CA-C-N 115.747 -0.661 . . . . 0.0 114.272 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -90.1 -47.18 7.98 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.709 0.804 . . . . 0.0 110.687 -176.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.569 HG12 ' HA ' ' A' ' 30' ' ' LEU . 43.8 mm -75.63 122.16 86.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.07 -8.55 23.92 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.797 2.331 . . . . 0.0 113.288 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.423 ' H ' HG22 ' A' ' 34' ' ' ILE . 58.7 mm-40 -90.49 -28.85 18.29 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 173.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.601 HD12 ' HA ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -74.53 94.26 2.6 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 32.1 t70 -125.74 -166.21 1.53 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 125.246 1.418 . . . . 0.0 107.705 171.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.562 ' HB3' H282 ' A' ' 84' ' ' PNS . 12.9 m -41.82 -69.39 0.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.605 1.562 . . . . 0.0 114.58 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 mmt -70.74 -23.92 62.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.242 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 45' ' ' VAL . . . -60.71 -41.77 95.88 Favored 'General case' 0 C--N 1.345 0.392 0 O-C-N 123.932 0.77 . . . . 0.0 111.405 172.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -63.13 -42.38 96.33 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.1 t -63.81 -45.6 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.729 0.776 . . . . 0.0 110.354 -176.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -58.23 -47.96 81.88 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.502 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.458 ' O ' HD23 ' A' ' 49' ' ' LEU . 24.8 m -76.01 -25.29 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 119.069 -0.491 . . . . 0.0 112.017 -175.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 42' ' ' VAL . 90.7 mt -62.74 -55.73 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 171.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.7 m -54.98 -46.91 75.14 Favored 'General case' 0 C--N 1.356 0.888 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.795 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.97 89.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.991 0.917 . . . . 0.0 111.621 -177.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -53.89 -43.55 69.75 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.293 0.637 . . . . 0.0 110.071 175.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.478 ' HG2' ' H ' ' A' ' 57' ' ' VAL . 42.9 mt-10 -61.8 -45.4 94.0 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.309 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 47' ' ' THR . 44.1 mm-40 -63.39 -55.18 26.51 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.177 0.591 . . . . 0.0 111.477 -176.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -69.0 -42.06 76.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.147 0.579 . . . . 0.0 112.439 -174.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -82.65 -11.31 58.46 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 66.43 38.02 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.654 1.182 . . . . 0.0 111.69 174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.3 -168.7 1.87 Allowed 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.716 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.5 t -133.51 116.99 16.62 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 167.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.478 ' H ' ' HG2' ' A' ' 50' ' ' GLU . 48.0 t -69.75 113.8 6.17 Favored 'Isoleucine or valine' 0 C--N 1.351 0.636 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 173.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.512 ' O ' HG13 ' A' ' 62' ' ' ILE . 26.0 t70 -70.3 148.85 48.02 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.671 0.789 . . . . 0.0 110.784 -173.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -56.97 -41.49 78.44 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.336 0.654 . . . . 0.0 112.491 -176.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -66.63 -27.29 67.57 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.51 0.724 . . . . 0.0 112.308 -174.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -95.79 -5.42 41.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.241 0.616 . . . . 0.0 111.129 -177.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 58' ' ' ASP . 58.2 mt -83.67 106.82 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 122.735 0.414 . . . . 0.0 110.02 175.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -128.28 173.98 9.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.035 0.934 . . . . 0.0 109.546 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.509 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -67.91 -31.27 70.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.079 0.552 . . . . 0.0 110.149 169.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -67.11 -18.97 65.55 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.396 175.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.5 m -73.68 -37.28 65.28 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.557 ' HA ' HD21 ' A' ' 73' ' ' LEU . 68.1 m-85 -107.83 15.76 24.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.519 0.728 . . . . 0.0 112.196 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.78 -42.69 94.89 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.371 0.419 . . . . 0.0 110.477 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.0 t -146.85 166.18 27.47 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.034 0.534 . . . . 0.0 110.606 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 24' ' ' LEU . 61.9 tp -62.47 -35.48 79.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.071 0.549 . . . . 0.0 110.681 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.24 -32.14 79.6 Favored Glycine 0 C--N 1.351 1.402 0 O-C-N 123.688 0.618 . . . . 0.0 112.72 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.4 m -68.4 -52.65 30.61 Favored 'General case' 0 C--N 1.347 0.5 0 C-N-CA 123.161 0.585 . . . . 0.0 110.469 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.557 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.1 mm? -61.57 -42.24 98.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 117.812 0.278 . . . . 0.0 111.497 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.547 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.46 -46.74 80.22 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.071 0.857 . . . . 0.0 110.248 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.9 -49.66 76.83 Favored 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 124.208 1.003 . . . . 0.0 110.599 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.47 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 18.1 m-85 -60.07 -50.47 73.59 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.52 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.71 -28.89 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.652 0.381 . . . . 0.0 111.695 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 50.2 mm-40 -60.27 -46.79 88.61 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 170.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.27 -29.4 70.49 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.927 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -70.32 -56.61 6.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.101 0.56 . . . . 0.0 111.908 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.21 -14.02 62.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.547 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -82.88 -47.77 11.46 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 122.259 0.224 . . . . 0.0 110.614 170.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.726 -178.425 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.562 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.451 HE21 ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -101.3 -37.8 8.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.341 1.056 . . . . 0.0 110.841 176.033 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.442 ' O ' HG23 ' A' ' 7' ' ' VAL . 79.4 m-70 -79.93 -16.5 55.16 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -169.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 8' ' ' ARG . 2.4 pt? -53.5 -28.67 32.21 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.499 0.59 . . . . 0.0 111.622 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -57.81 -56.54 20.69 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.496 1.518 . . . . 0.0 110.409 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.414 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.41 -28.3 64.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.802 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 3' ' ' HIS . 95.2 t -68.29 -50.6 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.075 0 C-N-CA 122.474 0.31 . . . . 0.0 110.924 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 19.0 ptt85 -70.52 -24.04 62.75 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.415 0.286 . . . . 0.0 110.56 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.14 -48.47 81.46 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.795 170.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 6' ' ' ALA . 81.3 mt -60.48 -57.73 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.936 0.894 . . . . 0.0 111.74 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.46 ' HG ' HG11 ' A' ' 45' ' ' VAL . 9.2 mp -64.31 -34.92 79.25 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 123.083 0.239 . . . . 0.0 110.999 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.567 ' HA3' ' HD2' ' A' ' 21' ' ' LYS . . . -66.51 -34.39 87.55 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-N 116.239 -0.437 . . . . 0.0 113.376 174.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -72.06 -52.05 18.7 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.577 0.751 . . . . 0.0 109.893 -178.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.4 t -66.63 -53.17 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.014 0.926 . . . . 0.0 110.655 -173.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.436 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.6 mm? -87.91 -5.24 58.66 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 65.1 56.02 1.07 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.996 0.903 . . . . 0.0 110.925 174.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.521 HD23 ' HA2' ' A' ' 12' ' ' GLY . 4.3 mm? -70.48 -31.7 68.93 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 178.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 73.89 -98.58 0.98 Allowed Glycine 0 C--N 1.342 0.877 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.334 -178.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.69 -11.74 19.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.953 0.901 . . . . 0.0 111.152 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -72.26 -29.29 63.77 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -178.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HD2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -69.15 -10.76 59.23 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 173.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -89.35 -36.94 15.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.116 0.566 . . . . 0.0 110.722 177.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.2 t -76.88 -21.61 54.69 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.647 0.379 . . . . 0.0 111.217 -173.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 pp -86.99 146.84 25.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.8 p -123.72 -169.47 1.95 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.463 1.105 . . . . 0.0 109.218 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.78 72.87 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.611 0.364 . . . . 0.0 110.786 173.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.8 m -80.78 2.56 25.71 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.627 0.771 . . . . 0.0 112.44 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -95.29 145.57 24.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.84 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -77.95 156.87 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 124.303 1.041 . . . . 0.0 109.139 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 70' ' ' LEU . 82.5 mt -119.87 -62.98 1.42 Allowed 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.902 -0.499 . . . . 0.0 110.234 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 37' ' ' LEU . 93.8 mt -55.34 112.3 1.07 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.307 0.643 . . . . 0.0 110.984 172.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.49 -33.48 4.95 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.017 -0.538 . . . . 0.0 113.328 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.43 -41.31 69.66 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.165 0.586 . . . . 0.0 110.174 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.505 HD12 HD11 ' A' ' 17' ' ' LEU . 20.3 mm -90.35 119.22 69.19 Favored Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 174.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.86 -12.28 32.41 Favored 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.685 2.256 . . . . 0.0 112.79 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.406 ' H ' HG22 ' A' ' 34' ' ' ILE . 36.4 mm-40 -93.15 -23.87 18.44 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.169 0.588 . . . . 0.0 111.384 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 31' ' ' LEU . 1.2 tm? -79.46 82.32 5.6 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -176.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.475 ' O ' HG13 ' A' ' 42' ' ' VAL . 17.9 t70 -115.68 -155.34 0.57 Allowed 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 125.081 1.352 . . . . 0.0 108.739 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.606 ' O ' HG22 ' A' ' 42' ' ' VAL . 36.0 t -54.26 -71.7 0.07 Allowed 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.078 1.351 . . . . 0.0 113.991 -169.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.67 -24.08 67.64 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.649 -0.657 . . . . 0.0 112.016 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.453 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -67.87 -37.97 82.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.45 0.7 . . . . 0.0 111.678 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 39' ' ' SER . 6.3 m -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 C--N 1.369 1.456 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 174.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.471 HG21 H312 ' A' ' 84' ' ' PNS . 10.7 t -70.33 -40.49 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.829 -176.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -63.81 -41.22 97.93 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.233 1.013 . . . . 0.0 112.076 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.46 HG11 ' HG ' ' A' ' 11' ' ' LEU . 21.7 m -74.37 -33.06 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.355 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.454 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.8 mt -59.43 -47.28 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 41.5 m -59.18 -43.48 92.16 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.109 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -32.26 73.54 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.679 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.8 -45.58 91.89 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 2.4 mm-40 -57.39 -49.34 76.5 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.617 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 47' ' ' THR . 17.6 mm-40 -67.02 -52.45 42.24 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.465 0.706 . . . . 0.0 111.995 -174.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.66 -60.66 3.33 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.7 0.8 . . . . 0.0 111.718 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -78.02 -17.77 56.68 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.232 0.332 . . . . 0.0 111.43 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 65.6 62.43 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.768 1.227 . . . . 0.0 109.82 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.38 -166.61 2.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.656 176.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.5 m -133.01 113.09 12.4 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 123.204 0.602 . . . . 0.0 109.974 167.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 70.7 t -73.17 108.84 4.81 Favored 'Isoleucine or valine' 0 C--N 1.352 0.713 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 167.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 22.9 t70 -63.08 148.91 46.48 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.509 -171.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.3 -32.09 71.94 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.895 0.478 . . . . 0.0 112.0 -175.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -70.19 -27.92 64.89 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.535 0.734 . . . . 0.0 111.533 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 13.1 pt-20 -92.68 -12.48 31.39 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.183 0.193 . . . . 0.0 110.973 -178.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 58' ' ' ASP . 45.5 mt -84.91 106.94 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 122.92 0.488 . . . . 0.0 110.149 175.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.2 p -130.0 179.68 5.73 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.361 1.064 . . . . 0.0 108.703 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.37 -34.5 78.31 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.014 174.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -67.92 -12.71 61.23 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.314 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -70.65 -40.09 73.25 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.829 0.451 . . . . 0.0 110.603 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.598 ' HB2' ' S44' ' A' ' 84' ' ' PNS . 52.5 m-85 -107.61 18.26 21.66 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 69' ' ' THR . 11.1 pt-20 -61.73 -38.35 87.58 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 177.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 72' ' ' SER . 8.3 t -146.24 160.6 41.77 Favored 'General case' 0 C--O 1.25 1.103 0 C-N-CA 123.315 0.646 . . . . 0.0 110.729 175.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.41 ' HA ' HD11 ' A' ' 30' ' ' LEU . 12.5 tp -63.6 -29.62 70.84 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.67 -38.22 95.37 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.992 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.509 ' H ' HG23 ' A' ' 69' ' ' THR . 64.4 m -58.67 -51.53 69.52 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -58.37 -45.48 88.19 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 123.667 0.605 . . . . 0.0 111.194 176.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.592 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -55.45 -45.45 76.86 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.708 1.255 . . . . 0.0 110.143 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.47 -43.57 85.09 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.724 0.64 . . . . 0.0 111.548 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 21.3 m-85 -54.32 -55.78 25.04 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.5 m -73.39 -24.79 20.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.148 0.979 . . . . 0.0 112.301 -174.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 73.0 mm-40 -55.64 -54.95 37.88 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 168.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -69.08 -32.08 71.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.765 -171.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -57.71 -54.96 41.0 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.23 0.612 . . . . 0.0 110.721 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.401 HD22 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -80.73 -13.55 58.89 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.777 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.2 m -72.01 -31.16 65.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.362 0.265 . . . . 0.0 110.413 170.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 35.1 m170 . . . . . 0 CA--C 1.549 0.924 0 C-N-CA 123.312 0.645 . . . . 0.0 109.416 179.221 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.598 ' S44' ' HB2' ' A' ' 67' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -94.51 -53.96 3.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 122.05 0.929 . . . . 0.0 108.741 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 7' ' ' VAL . 97.6 m-70 -70.8 -17.71 62.76 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.0 -1.909 . . . . 0.0 113.419 -164.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -50.09 -34.35 21.55 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -72.3 -42.37 65.55 Favored 'General case' 0 C--N 1.354 0.796 0 C-N-CA 122.511 0.324 . . . . 0.0 110.617 -176.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.83 -33.88 76.87 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.214 0.605 . . . . 0.0 111.07 175.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 3' ' ' HIS . 83.9 t -66.66 -50.79 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.153 0.581 . . . . 0.0 109.767 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.9 ptt180 -68.6 -26.83 65.57 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.711 0.404 . . . . 0.0 110.634 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.404 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 32.0 t30 -61.64 -50.01 74.24 Favored 'General case' 0 C--O 1.25 1.09 0 C-N-CA 123.996 0.919 . . . . 0.0 109.758 175.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.19 -50.06 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.719 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.3 mt -58.86 -39.89 82.7 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.433 0.693 . . . . 0.0 111.475 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.452 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -71.98 -28.08 69.29 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-O 119.851 -0.416 . . . . 0.0 113.337 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -75.41 -39.51 58.88 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 117.031 0.415 . . . . 0.0 110.686 175.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.2 t -75.18 -54.29 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.005 0.522 . . . . 0.0 110.493 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.542 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.4 mm? -84.78 1.44 46.7 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.172 0.589 . . . . 0.0 112.072 -176.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 65.82 46.61 2.26 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 122.22 1.009 . . . . 0.0 111.245 170.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 mp -77.52 -34.95 53.88 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.873 172.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.49 -91.24 0.25 Allowed Glycine 0 C--N 1.352 1.455 0 O-C-N 123.912 0.757 . . . . 0.0 113.072 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -92.5 -28.92 16.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.984 0.914 . . . . 0.0 110.657 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.2 OUTLIER -65.54 -24.64 67.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.692 0.797 . . . . 0.0 111.435 -173.492 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.452 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 61.0 pttt -65.18 -27.03 68.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.847 0.459 . . . . 0.0 111.817 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 36.8 t-80 -92.01 -22.96 19.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.774 0.43 . . . . 0.0 110.877 -175.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.473 HG22 ' HA ' ' A' ' 20' ' ' ARG . 7.2 t -86.15 -1.05 57.06 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.359 0.264 . . . . 0.0 111.187 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -103.64 156.43 17.8 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.956 0.408 . . . . 0.0 110.146 172.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.3 p -121.51 -172.34 2.4 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.216 1.006 . . . . 0.0 110.178 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.3 81.23 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 t -75.18 -3.73 34.7 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.002 0.521 . . . . 0.0 112.194 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.1 t -67.68 137.1 55.29 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.001 0.521 . . . . 0.0 110.498 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -86.7 150.69 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.918 0.887 . . . . 0.0 109.863 -177.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.3 mt -109.02 -66.93 1.01 Allowed 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.5 mt -54.41 121.39 8.21 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.842 0.857 . . . . 0.0 111.264 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.76 -28.56 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 119.533 -0.593 . . . . 0.0 113.809 -179.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -77.71 -66.21 0.87 Allowed 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.498 0.649 . . . . 0.0 110.021 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.4 mm -77.16 119.27 76.81 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.192 -175.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.99 -15.52 36.26 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 122.315 2.01 . . . . 0.0 111.899 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -88.04 -29.26 20.81 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.944 0.898 . . . . 0.0 110.152 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.8 100.57 3.48 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.441 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 27.1 t70 -132.52 -156.83 0.78 Allowed 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 171.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.716 ' O ' HG22 ' A' ' 42' ' ' VAL . 58.0 p -67.46 -54.52 19.5 Favored 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -167.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 97.0 mmm -61.55 -27.52 68.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.691 -1.255 . . . . 0.0 111.263 177.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.542 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -68.24 -33.73 74.93 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.795 175.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.716 HG22 ' O ' ' A' ' 39' ' ' SER . 5.9 m -64.68 -37.62 80.58 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 118.791 0.723 . . . . 0.0 109.645 175.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.49 -48.15 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 121.499 0.666 . . . . 0.0 109.956 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -60.41 -45.84 92.15 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 113.799 -1.546 . . . . 0.0 112.634 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' HD23 ' A' ' 49' ' ' LEU . 32.6 m -71.05 -31.94 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 119.031 -0.509 . . . . 0.0 111.575 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.424 HD13 HD13 ' A' ' 62' ' ' ILE . 82.3 mt -63.48 -50.57 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -50.91 -48.76 60.52 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.508 1.13 . . . . 0.0 110.922 177.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.44 -46.82 84.5 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.798 -178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.3 mm? -55.2 -45.23 75.86 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.576 0.75 . . . . 0.0 110.366 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.5 -40.1 96.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.823 0.849 . . . . 0.0 112.05 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -65.48 -52.52 52.27 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.43 0.692 . . . . 0.0 112.139 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.49 -49.48 40.78 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -176.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -75.45 -16.76 60.3 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.834 0.454 . . . . 0.0 111.755 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.6 t70 64.49 46.76 3.2 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.432 1.11 . . . . 0.0 110.273 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.93 -170.78 2.58 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.483 175.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.9 t -126.08 117.14 22.56 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 166.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.0 t -69.12 108.54 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.76 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.592 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.2 t70 -72.8 144.23 47.61 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.463 0.705 . . . . 0.0 111.286 -169.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.55 -38.7 64.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.875 0.87 . . . . 0.0 112.626 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -71.6 -21.19 61.89 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.218 0.607 . . . . 0.0 111.99 -172.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 10.8 pt-20 -94.6 -17.39 22.36 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.424 HD13 HD13 ' A' ' 46' ' ' ILE . 76.7 mt -81.05 109.39 15.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 123.185 0.594 . . . . 0.0 110.078 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.3 t -130.11 170.4 14.08 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 164.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.91 76.06 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -63.95 -18.97 64.78 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.498 0.719 . . . . 0.0 112.243 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 92.6 m -64.47 -38.81 92.3 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.283 0.633 . . . . 0.0 110.097 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.571 ' HA ' HD21 ' A' ' 73' ' ' LEU . 77.3 m-85 -96.17 19.45 11.77 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.34 1.056 . . . . 0.0 112.623 -177.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.64 -48.9 77.36 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 123.091 0.244 . . . . 0.0 110.447 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.6 p -142.05 162.59 35.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.816 0.847 . . . . 0.0 110.395 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 60.9 tp -56.29 -40.32 74.12 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.017 0.927 . . . . 0.0 111.386 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.74 -35.45 92.03 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 114.513 -1.222 . . . . 0.0 112.034 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.3 m -62.2 -51.03 69.43 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 122.959 0.504 . . . . 0.0 110.483 177.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.571 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.8 mm? -57.07 -42.56 80.84 Favored 'General case' 0 C--N 1.365 1.266 0 O-C-N 123.558 0.536 . . . . 0.0 109.887 176.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.571 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.74 -43.25 85.24 Favored 'General case' 0 C--O 1.21 -1.018 0 O-C-N 124.686 1.241 . . . . 0.0 110.973 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.87 -51.47 68.07 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 123.864 0.727 . . . . 0.0 110.791 178.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.529 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 68.5 m-85 -55.69 -49.7 72.25 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 123.668 0.605 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.2 m -72.64 -24.86 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.163 0.585 . . . . 0.0 112.018 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.5 mm-40 -56.82 -53.73 54.53 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 169.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -58.69 -43.24 89.93 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.487 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -53.52 -59.02 5.13 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 124.118 0.886 . . . . 0.0 112.157 -177.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 80' ' ' LYS . 2.8 mm? -79.22 -13.89 59.41 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.121 -174.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.2 m -80.33 -10.56 59.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.751 0.42 . . . . 0.0 111.478 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.18 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.711 H301 ' HB2' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -36.71 -47.36 0.66 Allowed 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 115.903 1.816 . . . . 0.0 115.903 -162.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.412 ' O ' HG23 ' A' ' 7' ' ' VAL . 39.1 m-70 -68.48 -25.98 65.25 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.47 -30.78 8.69 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 123.925 0.89 . . . . 0.0 112.776 -179.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.86 -50.58 66.05 Favored 'General case' 0 C--N 1.352 0.692 0 C-N-CA 124.315 1.046 . . . . 0.0 110.797 -176.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.22 -25.7 55.33 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.882 -179.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 3' ' ' HIS . 70.5 t -67.29 -49.59 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -71.55 -24.46 61.94 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.096 0.558 . . . . 0.0 110.3 -178.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -60.95 -50.26 74.12 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.252 0.621 . . . . 0.0 109.666 171.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.35 -46.86 95.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.481 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.2 mt -62.71 -42.51 99.68 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.01 0.524 . . . . 0.0 110.494 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.586 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -68.17 -22.15 74.23 Favored Glycine 0 C--N 1.342 0.911 0 CA-C-N 115.436 -0.802 . . . . 0.0 113.239 178.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -84.3 -47.44 10.75 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.372 0.669 . . . . 0.0 111.504 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.16 -58.24 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.455 0.702 . . . . 0.0 110.447 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.5 mm? -80.76 -14.02 58.46 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.792 0.437 . . . . 0.0 110.605 -175.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 67.16 64.47 0.44 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.338 1.055 . . . . 0.0 109.714 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.492 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 3.6 mm? -79.33 -27.04 42.07 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.386 -0.825 . . . . 0.0 108.904 164.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 64.43 -100.82 0.45 Allowed Glycine 0 C--N 1.354 1.55 0 O-C-N 123.664 0.602 . . . . 0.0 113.636 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -89.09 -23.63 22.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.955 0.902 . . . . 0.0 110.795 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' HD12 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -70.81 -22.6 62.33 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.573 0.749 . . . . 0.0 111.003 -176.41 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 22.8 pttm -63.99 -23.6 67.4 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.138 -0.351 . . . . 0.0 110.927 173.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -80.69 -23.83 39.3 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.364 0.666 . . . . 0.0 111.485 -178.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.4 t -94.43 -15.72 24.03 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -91.27 149.48 21.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 81.4 p -118.4 -169.89 1.79 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.361 1.064 . . . . 0.0 109.36 -177.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.17 63.8 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 122.927 0.491 . . . . 0.0 112.195 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -74.16 -16.53 60.99 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.978 0.911 . . . . 0.0 112.452 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.6 p -66.51 123.11 19.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.03 0.532 . . . . 0.0 111.043 -176.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.5 t -75.98 148.67 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 175.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.411 ' HA ' HG12 ' A' ' 34' ' ' ILE . 74.5 mt -113.83 -67.65 0.98 Allowed 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.076 -0.39 . . . . 0.0 110.145 -178.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.89 111.37 1.14 Allowed 'General case' 0 C--N 1.35 0.625 0 C-N-CA 122.98 0.512 . . . . 0.0 110.926 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 -34.62 4.98 Favored Glycine 0 C--N 1.34 0.785 0 CA-C-N 115.216 -0.902 . . . . 0.0 113.191 178.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -80.76 -45.57 16.82 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.266 0.626 . . . . 0.0 110.856 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 30' ' ' LEU . 23.4 mm -90.67 116.15 65.77 Favored Pre-proline 0 C--O 1.243 0.734 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 177.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.15 -4.86 14.71 Favored 'Trans proline' 0 C--N 1.368 1.583 0 C-N-CA 122.446 2.097 . . . . 0.0 112.401 -177.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 14.4 mm-40 -89.26 -18.42 27.05 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.397 0.679 . . . . 0.0 110.151 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 56.9 tp -83.63 87.64 7.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.597 0.713 . . . . 0.0 109.189 -177.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.407 ' N ' ' HB3' ' A' ' 41' ' ' ALA . 29.6 t70 -85.53 173.14 10.42 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.94 1.296 . . . . 0.0 110.287 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.665 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.9 t -49.32 -65.21 0.61 Allowed 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 125.337 1.455 . . . . 0.0 112.231 169.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.0 mmt -60.88 -23.76 65.44 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.306 -0.871 . . . . 0.0 111.981 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.407 ' HB3' ' N ' ' A' ' 38' ' ' ASP . . . -73.14 -28.39 62.22 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.665 HG22 ' O ' ' A' ' 39' ' ' SER . 4.3 m -66.16 -37.53 79.95 Favored 'Isoleucine or valine' 0 C--N 1.366 1.325 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 171.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.494 HG21 H312 ' A' ' 84' ' ' PNS . 3.0 t -67.0 -39.45 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.85 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -59.66 -47.4 85.76 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.756 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.48 -30.46 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.753 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.5 HD13 HD13 ' A' ' 62' ' ' ILE . 97.0 mt -64.5 -48.19 86.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 90.7 m -58.74 -44.71 90.57 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.267 0.979 . . . . 0.0 110.532 177.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.97 89.35 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.129 178.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -58.2 -45.77 87.0 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.146 0.578 . . . . 0.0 109.635 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 13.5 mm-40 -51.5 -49.25 62.24 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 124.325 1.015 . . . . 0.0 110.037 175.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 47' ' ' THR . 25.4 mm-40 -62.1 -66.32 0.56 Allowed 'General case' 0 C--N 1.353 0.727 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.695 -173.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -70.6 -37.14 73.85 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -168.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -88.33 -14.84 37.21 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.325 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 63.79 46.12 4.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.28 1.032 . . . . 0.0 111.548 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.515 ' CZ ' HG22 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -141.52 -171.94 3.42 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.316 -179.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.5 t -126.0 130.91 52.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 122.918 0.487 . . . . 0.0 110.149 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.515 HG22 ' CZ ' ' A' ' 55' ' ' PHE . 2.6 t -86.31 118.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 172.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 27.0 t70 -76.08 144.8 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.4 0.68 . . . . 0.0 111.838 -170.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -55.22 -40.06 70.4 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.131 0.973 . . . . 0.0 113.377 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.34 -32.32 68.41 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.276 0.631 . . . . 0.0 112.068 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.4 pt-20 -85.96 -23.62 26.85 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.5 HD13 HD13 ' A' ' 46' ' ' ILE . 68.9 mt -72.25 110.12 5.05 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.3 t -139.76 175.82 9.25 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 171.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.9 71.61 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -63.97 -21.4 66.47 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.143 0.977 . . . . 0.0 112.26 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.451 HG22 HD13 ' A' ' 73' ' ' LEU . 20.7 m -81.97 -41.13 21.21 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.189 0.595 . . . . 0.0 110.17 175.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.508 ' HA ' HD21 ' A' ' 73' ' ' LEU . 61.9 m-85 -101.02 7.25 43.57 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.573 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -62.33 -41.24 98.39 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.948 0.499 . . . . 0.0 111.426 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.573 HG22 ' HG3' ' A' ' 68' ' ' GLU . 7.1 t -148.6 154.76 40.17 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.518 0.727 . . . . 0.0 110.052 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.2 tp -56.21 -33.02 64.94 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.201 1.0 . . . . 0.0 111.604 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.18 -43.25 99.64 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.531 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -61.88 -44.14 97.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.968 0.507 . . . . 0.0 111.05 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.5 mm? -59.01 -47.57 84.71 Favored 'General case' 0 C--N 1.363 1.166 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 176.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.612 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -53.41 -52.86 58.01 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 124.624 1.203 . . . . 0.0 110.031 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.1 -45.15 93.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.11 0.964 . . . . 0.0 112.224 -174.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.462 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 29.7 m-85 -60.44 -49.89 75.77 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.256 0.222 . . . . 0.0 110.867 177.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.2 m -71.39 -23.84 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 122.521 0.329 . . . . 0.0 111.132 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 81.8 mm-40 -56.86 -50.48 72.33 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -57.79 -47.96 81.07 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 124.108 0.88 . . . . 0.0 110.733 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.6 mmmt -62.7 -55.01 30.71 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.209 -172.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.69 -12.24 60.95 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.511 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 52.6 m -89.51 -27.17 20.49 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 123.057 0.543 . . . . 0.0 111.49 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.009 -179.224 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.57 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mpp? . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 120.767 0.318 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -92.25 -45.59 8.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.289 1.042 . . . . 0.0 108.216 176.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -79.48 -9.84 59.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 113.498 -1.683 . . . . 0.0 113.597 -164.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -53.13 -30.27 35.86 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.632 0.651 . . . . 0.0 112.341 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.68 -51.67 61.26 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.048 0.939 . . . . 0.0 110.793 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.56 -35.55 75.5 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.429 -177.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.2 t -63.91 -50.34 77.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 122.923 0.489 . . . . 0.0 109.814 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -67.88 -28.65 67.7 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.773 0.429 . . . . 0.0 110.461 -177.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -61.89 -48.77 79.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.656 0.782 . . . . 0.0 109.881 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 6' ' ' ALA . 91.5 mt -59.13 -55.24 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.191 0.996 . . . . 0.0 110.995 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 mt -58.37 -45.2 88.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.116 -174.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -74.37 -19.48 79.83 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 116.265 -0.425 . . . . 0.0 113.536 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.8 -38.33 58.29 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.983 0.391 . . . . 0.0 110.104 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -75.29 -56.43 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.529 0.732 . . . . 0.0 110.37 -178.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.431 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 1.4 mm? -81.75 2.19 31.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.513 0.725 . . . . 0.0 112.031 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 69.6 34.49 2.72 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.434 1.093 . . . . 0.0 111.897 168.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HG ' ' HD2' ' A' ' 20' ' ' ARG . 6.0 mp -68.12 -33.71 75.01 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.872 0.869 . . . . 0.0 111.256 177.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.26 -95.13 0.57 Allowed Glycine 0 C--N 1.351 1.411 0 O-C-N 123.463 0.477 . . . . 0.0 113.095 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -96.33 -24.7 16.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.0 0.92 . . . . 0.0 110.434 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.1 OUTLIER -61.68 -28.74 69.61 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.424 0.69 . . . . 0.0 111.423 -176.103 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.2 pttt -65.98 -26.25 67.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.376 0.67 . . . . 0.0 112.224 177.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -96.73 -20.93 17.88 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.272 0.629 . . . . 0.0 110.998 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.526 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.1 t -87.2 4.96 40.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.769 0.427 . . . . 0.0 111.38 179.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 pp -107.69 169.87 8.33 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.376 0.67 . . . . 0.0 109.684 171.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.5 p -127.18 -171.38 2.4 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 0.0 109.56 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.74 -31.54 70.86 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.907 0.483 . . . . 0.0 112.016 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -73.4 -4.93 36.58 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -71.6 129.74 39.46 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.03 0.532 . . . . 0.0 110.835 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.405 ' HB ' ' HB2' ' A' ' 33' ' ' ASN . 59.2 t -73.63 155.33 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 124.409 1.083 . . . . 0.0 108.72 171.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 27.3 mt -124.59 -67.13 0.93 Allowed 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 68' ' ' GLU . 5.2 tt -64.96 110.86 2.6 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 172.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.98 -32.13 7.83 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 123.477 0.486 . . . . 0.0 112.73 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.405 ' HB2' ' HB ' ' A' ' 29' ' ' VAL . 53.7 t-20 -84.31 -65.41 1.01 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.78 0.832 . . . . 0.0 110.434 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.424 HG22 ' H ' ' A' ' 36' ' ' GLU . 27.4 mm -71.86 118.12 63.96 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.527 -171.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.92 -4.13 14.85 Favored 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 122.559 2.173 . . . . 0.0 112.442 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 37.7 mm-40 -99.32 -10.24 22.56 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.318 1.047 . . . . 0.0 111.045 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -78.29 82.95 4.56 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.463 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 25.3 t70 -91.85 169.63 10.53 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.587 1.555 . . . . 0.0 110.439 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.573 ' O ' HG22 ' A' ' 42' ' ' VAL . 45.9 t -44.25 -65.73 0.48 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 126.508 1.923 . . . . 0.0 112.637 170.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.4 mmm -68.03 -21.73 65.0 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 121.896 -0.503 . . . . 0.0 111.522 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.463 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -74.49 -23.87 58.93 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 118.273 -0.87 . . . . 0.0 112.053 174.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' SER . 2.9 m -67.96 -39.55 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 171.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 t -63.35 -44.46 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.162 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -62.06 -44.37 96.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.306 -1.316 . . . . 0.0 112.887 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 28.1 m -74.2 -30.37 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-O 119.318 -0.373 . . . . 0.0 111.595 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.519 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -61.56 -55.86 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.46 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.9 m -56.12 -39.83 72.82 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 124.629 1.206 . . . . 0.0 111.369 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.403 ' O ' ' HD1' ' A' ' 52' ' ' TYR . . . -64.69 -46.01 84.19 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.767 0.827 . . . . 0.0 111.69 178.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.403 HD22 HG21 ' A' ' 10' ' ' ILE . 3.5 mm? -54.96 -44.8 74.7 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.328 0.651 . . . . 0.0 110.244 174.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 10.2 mm-40 -53.72 -50.02 66.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.524 1.129 . . . . 0.0 111.447 176.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.6 mm-40 -64.84 -55.8 17.33 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.542 0.737 . . . . 0.0 111.954 -174.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.403 ' HD1' ' O ' ' A' ' 48' ' ' ALA . 56.5 m-85 -62.6 -56.02 21.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.365 0.666 . . . . 0.0 111.954 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.39 -9.74 59.66 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.2 t70 67.15 35.4 4.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 124.502 1.121 . . . . 0.0 111.106 169.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -173.6 3.44 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.262 0.625 . . . . 0.0 110.772 -171.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.4 m -128.9 113.43 15.22 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.382 0.673 . . . . 0.0 111.362 172.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.7 t -70.74 118.3 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 164.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.591 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 20.7 t70 -72.28 145.88 47.57 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.175 0.443 . . . . 0.0 109.98 -174.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.46 -25.98 67.75 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 121.706 -0.621 . . . . 0.0 112.468 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -76.44 -7.2 54.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.952 0.501 . . . . 0.0 112.071 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.9 pt-20 -111.29 -20.25 12.36 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.825 0.45 . . . . 0.0 110.575 172.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 58' ' ' ASP . 56.3 mt -77.69 114.58 18.38 Favored 'Isoleucine or valine' 0 C--N 1.357 0.928 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 175.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.417 ' O ' ' S44' ' A' ' 84' ' ' PNS . 88.6 p -131.75 177.22 7.69 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.676 1.191 . . . . 0.0 108.127 168.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.04 73.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.676 0.75 . . . . 0.0 109.756 171.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -69.79 -11.37 60.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.261 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.5 m -80.14 -40.46 27.34 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 122.797 0.439 . . . . 0.0 110.023 173.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.676 ' HA ' HD21 ' A' ' 73' ' ' LEU . 37.7 m-85 -99.31 14.03 31.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.548 0.339 . . . . 0.0 111.775 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 11.4 pt-20 -60.95 -40.39 93.11 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 123.786 0.679 . . . . 0.0 112.0 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.2 m -151.82 150.11 29.76 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.096 0.958 . . . . 0.0 109.796 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 tp -53.54 -42.75 67.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.125 0.97 . . . . 0.0 111.861 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.78 -38.23 91.7 Favored Glycine 0 C--N 1.341 0.822 0 O-C-N 124.534 1.146 . . . . 0.0 112.251 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m -58.79 -53.52 57.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.217 0.607 . . . . 0.0 110.268 177.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.676 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.26 -39.01 91.48 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.385 0.274 . . . . 0.0 110.816 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.611 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -60.8 -46.23 91.32 Favored 'General case' 0 C--O 1.213 -0.86 0 O-C-N 124.493 1.121 . . . . 0.0 110.334 -177.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -65.07 -44.39 89.11 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.885 0.741 . . . . 0.0 110.883 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.474 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 15.9 m-85 -56.61 -46.9 80.65 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.73 0.412 . . . . 0.0 111.06 179.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.8 m -75.3 -24.63 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 122.832 0.453 . . . . 0.0 111.596 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 68.5 mm-40 -57.53 -43.58 84.47 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 169.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -67.07 -55.88 12.41 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.211 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.2 mmmt -63.82 -54.21 38.63 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.698 0.799 . . . . 0.0 112.235 -168.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.82 -17.63 63.4 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m -97.2 -33.34 11.51 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.655 0.382 . . . . 0.0 111.191 177.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 . . . . . 0 C--O 1.249 1.06 0 C-N-CA 123.979 0.912 . . . . 0.0 109.113 -173.42 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.478 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.695 0.283 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.02 -50.98 3.99 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.58 0.752 . . . . 0.0 111.074 172.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -82.09 0.31 41.2 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.664 -171.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -55.38 -34.76 64.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 123.53 0.519 . . . . 0.0 111.771 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -68.52 -45.01 73.36 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.834 0.709 . . . . 0.0 110.593 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.79 -33.73 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.096 0.559 . . . . 0.0 111.03 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.5 t -66.84 -49.95 69.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 122.872 0.469 . . . . 0.0 109.772 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HG3' ' NZ ' ' A' ' 21' ' ' LYS . 36.3 ptt180 -70.8 -22.18 62.39 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.172 0.589 . . . . 0.0 110.877 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -65.05 -52.89 53.25 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.58 0.752 . . . . 0.0 109.57 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.64 -44.62 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.948 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 65.2 mt -63.38 -44.12 95.65 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.697 0.76 . . . . 0.0 110.277 175.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.557 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -66.72 -19.18 69.06 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 114.665 -1.152 . . . . 0.0 113.582 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -90.83 -52.73 4.72 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.243 0.617 . . . . 0.0 110.788 176.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 84.7 t -68.42 -47.24 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.981 0.912 . . . . 0.0 110.815 -173.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.654 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.2 mm? -83.75 -14.29 51.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.768 0.427 . . . . 0.0 110.791 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 63.26 62.72 0.96 Allowed 'General case' 0 C--N 1.355 0.825 0 C-N-CA 124.446 1.099 . . . . 0.0 110.286 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.557 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 10.0 mp -72.88 -34.34 66.64 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 114.915 -1.038 . . . . 0.0 109.2 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.35 -94.61 0.27 Allowed Glycine 0 C--N 1.353 1.492 0 O-C-N 123.908 0.755 . . . . 0.0 112.418 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -92.95 -18.49 22.67 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.521 0.728 . . . . 0.0 110.614 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.457 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -65.4 -31.43 72.53 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.731 0.412 . . . . 0.0 110.19 -178.381 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.403 ' NZ ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -70.0 -26.23 63.97 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.763 0.425 . . . . 0.0 111.823 174.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -70.58 -48.4 55.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 20' ' ' ARG . 8.2 t -77.42 -7.21 55.79 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.784 -167.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.644 ' HB2' ' HB2' ' A' ' 28' ' ' SER . 3.9 pp -103.22 157.2 17.17 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.679 0.392 . . . . 0.0 111.179 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 76.2 p -114.57 -169.54 1.56 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.327 1.051 . . . . 0.0 109.472 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.0 69.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.146 0.578 . . . . 0.0 111.35 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 m -69.54 -12.74 61.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.843 0.857 . . . . 0.0 112.847 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.644 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 46.0 t -59.21 134.56 57.1 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.972 0.909 . . . . 0.0 111.856 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -83.71 146.15 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.512 ' HA ' HG12 ' A' ' 34' ' ' ILE . 66.7 mt -114.27 -72.65 0.69 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.908 0.483 . . . . 0.0 110.642 179.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.35 113.36 2.87 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.23 -31.42 8.72 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-N 115.753 -0.658 . . . . 0.0 113.053 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -87.81 -57.61 2.88 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.838 0.455 . . . . 0.0 110.583 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.512 HG12 ' HA ' ' A' ' 30' ' ' LEU . 17.6 mm -71.74 119.82 76.44 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.45 -16.86 30.75 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.279 1.986 . . . . 0.0 111.807 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.435 ' H ' HG22 ' A' ' 34' ' ' ILE . 33.4 mm-40 -86.88 -21.33 26.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.491 0.717 . . . . 0.0 110.902 -177.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -74.39 86.1 2.0 Allowed 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -98.8 173.73 6.73 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.282 1.433 . . . . 0.0 109.731 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.655 ' HB3' H282 ' A' ' 84' ' ' PNS . 1.4 m -46.13 -64.52 0.73 Allowed 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 125.154 1.382 . . . . 0.0 113.22 169.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.7 mmt -63.71 -27.48 69.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 121.189 0.519 . . . . 0.0 110.928 -176.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -64.95 -35.96 82.84 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.583 174.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 39' ' ' SER . 3.7 m -66.47 -36.04 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-N 118.469 0.577 . . . . 0.0 109.644 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.451 HG22 H382 ' A' ' 84' ' ' PNS . 8.0 t -64.85 -47.37 88.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 CA-C-O 121.391 0.615 . . . . 0.0 109.9 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -58.72 -46.09 88.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.185 -1.371 . . . . 0.0 112.954 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.1 -33.45 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.977 -0.535 . . . . 0.0 111.722 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 78.8 mt -62.79 -51.55 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 67.6 m -52.25 -44.52 64.93 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.639 1.212 . . . . 0.0 110.95 177.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.67 -48.89 79.78 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.755 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.5 -46.05 66.48 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.684 0.794 . . . . 0.0 110.592 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 5.8 mm-40 -56.34 -47.86 77.92 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.462 1.105 . . . . 0.0 111.05 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 47' ' ' THR . 24.0 mm-40 -65.28 -52.24 55.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.662 0.785 . . . . 0.0 111.736 -176.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -71.2 -38.25 72.06 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.8 -171.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -94.02 -8.08 40.91 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.776 0.43 . . . . 0.0 111.893 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 67.36 28.23 7.91 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.594 1.158 . . . . 0.0 111.963 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -126.17 -177.67 4.04 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.219 0.608 . . . . 0.0 111.09 -171.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.5 m -127.14 121.1 30.45 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.81 0.844 . . . . 0.0 110.959 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.43 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 10.8 t -74.66 134.4 29.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.555 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 30.2 t70 -76.18 137.72 40.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.869 0.467 . . . . 0.0 109.911 -176.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.28 -39.05 81.71 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.345 0.658 . . . . 0.0 112.104 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.13 -4.51 41.96 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.542 0.737 . . . . 0.0 112.746 -172.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -100.97 -31.76 10.96 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 58' ' ' ASP . 35.4 mt -70.43 111.96 4.8 Favored 'Isoleucine or valine' 0 C--N 1.354 0.781 0 CA-C-O 121.261 0.553 . . . . 0.0 110.568 -176.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 42.2 t -112.27 171.96 7.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.65 1.18 . . . . 0.0 108.414 169.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.1 -30.05 68.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 167.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -71.98 -10.37 59.68 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.055 0.942 . . . . 0.0 111.542 176.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.429 HG22 HD13 ' A' ' 73' ' ' LEU . 96.3 m -69.25 -33.16 72.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.596 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.8 m-85 -89.36 11.49 18.96 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 69' ' ' THR . 9.8 pt-20 -58.76 -47.42 84.74 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 118.084 0.402 . . . . 0.0 110.792 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' GLU . 62.7 p -140.18 162.63 34.79 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.508 0.723 . . . . 0.0 111.125 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -59.71 -42.46 93.1 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 124.056 0.943 . . . . 0.0 110.924 176.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.99 -27.4 70.33 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 124.476 1.11 . . . . 0.0 112.616 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.7 m -67.67 -52.46 37.69 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 122.729 0.412 . . . . 0.0 110.754 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.7 mm? -60.81 -38.24 84.72 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 117.788 0.267 . . . . 0.0 110.769 176.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.01 63.11 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 124.344 1.027 . . . . 0.0 110.049 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.25 -44.91 92.36 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 123.967 0.792 . . . . 0.0 110.483 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.513 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 6.5 m-85 -58.62 -55.83 30.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.207 0.603 . . . . 0.0 111.512 -179.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 23.8 m -66.67 -27.36 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.412 0.285 . . . . 0.0 111.39 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.57 -28.26 63.72 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.051 0.54 . . . . 0.0 111.036 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 63.2 m170 -73.45 -38.16 65.57 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.753 0.421 . . . . 0.0 110.169 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -69.54 -54.07 15.93 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.887 0.875 . . . . 0.0 112.238 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.68 -14.47 60.35 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.958 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 51.5 m -95.61 -33.12 12.49 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 118.078 0.399 . . . . 0.0 110.559 174.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 57.6 m80 . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 124.02 0.928 . . . . 0.0 109.246 -176.936 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.655 H282 ' HB3' ' A' ' 39' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -36.91 9.98 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.356 0.662 . . . . 0.0 110.869 177.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -77.89 -14.2 59.63 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-O 118.541 -0.742 . . . . 0.0 112.948 -167.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -51.89 -34.0 39.32 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 123.439 0.695 . . . . 0.0 112.068 179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.49 -49.83 69.83 Favored 'General case' 0 C--N 1.352 0.715 0 C-N-CA 124.196 0.998 . . . . 0.0 110.671 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.64 -25.2 60.17 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.501 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 72.3 t -69.15 -48.83 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.634 0.373 . . . . 0.0 110.051 176.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 38.9 ptt180 -69.82 -25.58 63.83 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.52 0.328 . . . . 0.0 110.305 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -65.19 -47.42 77.01 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 123.577 0.548 . . . . 0.0 109.625 173.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.445 HG21 HD22 ' A' ' 49' ' ' LEU . 75.3 mt -61.22 -57.75 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.75 0.82 . . . . 0.0 111.428 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.546 HD22 HD13 ' A' ' 30' ' ' LEU . 9.9 mp -66.26 -29.61 69.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.626 0.37 . . . . 0.0 110.59 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.474 ' HA2' HD23 ' A' ' 17' ' ' LEU . . . -66.7 -29.07 74.15 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 119.912 -0.382 . . . . 0.0 113.003 172.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.18 -48.63 17.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.44 0.696 . . . . 0.0 110.557 176.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 10' ' ' ILE . 59.6 t -66.58 -56.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.526 0.731 . . . . 0.0 110.293 -174.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.546 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -84.54 -2.37 57.24 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.95 0.5 . . . . 0.0 110.982 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 58.0 t30 60.77 50.88 5.13 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.636 1.174 . . . . 0.0 111.533 170.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.496 HD11 HG23 ' A' ' 34' ' ' ILE . 2.7 mm? -72.69 -34.05 66.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.943 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 68.67 -90.7 0.25 Allowed Glycine 0 C--N 1.348 1.223 0 O-C-N 123.486 0.491 . . . . 0.0 112.772 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -94.01 -23.16 18.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.622 0.769 . . . . 0.0 111.012 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' HG22 ' A' ' 23' ' ' THR . 0.0 OUTLIER -68.32 -29.13 67.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' O ' ' HD2' ' A' ' 8' ' ' ARG . 9.5 pttm -69.89 -29.89 67.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.453 0.301 . . . . 0.0 111.017 173.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -75.52 -35.49 60.73 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.181 0.592 . . . . 0.0 110.775 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 20' ' ' ARG . 11.2 t -83.49 -22.33 32.55 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.938 0.495 . . . . 0.0 111.67 -174.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -82.45 143.77 30.92 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.4 p -118.98 -174.47 2.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.765 1.226 . . . . 0.0 110.225 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.41 88.8 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.292 0.567 . . . . 0.0 111.213 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 m -84.57 3.85 34.84 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.859 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.0 t -95.31 151.31 19.37 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.676 0.79 . . . . 0.0 110.16 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.1 t -87.14 148.79 4.38 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.162 1.385 . . . . 0.0 110.183 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.546 HD13 HD22 ' A' ' 11' ' ' LEU . 70.3 mt -114.72 -68.46 0.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.278 0.631 . . . . 0.0 109.737 175.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.66 112.54 2.29 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.518 0.727 . . . . 0.0 109.256 176.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.37 -40.38 2.5 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 123.615 0.572 . . . . 0.0 112.292 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -83.12 -34.64 26.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.382 0.673 . . . . 0.0 110.835 -174.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.496 HG23 HD11 ' A' ' 17' ' ' LEU . 34.7 mm -87.97 117.16 68.13 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 173.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.27 0.27 10.16 Favored 'Trans proline' 0 C--N 1.369 1.623 0 C-N-CA 122.711 2.274 . . . . 0.0 112.562 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.47 ' H ' HG22 ' A' ' 34' ' ' ILE . 10.9 mm-40 -95.08 -18.03 21.34 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.909 0.884 . . . . 0.0 109.947 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -81.45 92.54 6.47 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -107.12 -164.75 1.01 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.192 0.997 . . . . 0.0 111.068 176.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.581 ' O ' HG22 ' A' ' 42' ' ' VAL . 40.0 t -49.6 -69.3 0.12 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.294 1.838 . . . . 0.0 112.953 176.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.8 mmm -68.84 -19.06 64.25 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.895 -0.503 . . . . 0.0 111.233 -176.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -65.82 -43.3 89.0 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-O 118.706 -0.664 . . . . 0.0 111.538 174.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 39' ' ' SER . 4.5 m -61.43 -38.22 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.542 HG21 H312 ' A' ' 84' ' ' PNS . 7.4 t -66.38 -47.33 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.964 -176.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -61.51 -40.47 94.72 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.017 -1.447 . . . . 0.0 112.445 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.411 ' O ' HD23 ' A' ' 49' ' ' LEU . 31.0 m -77.38 -31.22 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.13 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 81.8 mt -61.76 -54.05 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 71.7 m -58.62 -39.5 80.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 124.807 1.317 . . . . 0.0 111.357 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -48.1 83.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.601 0.76 . . . . 0.0 111.195 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.445 HD22 HG21 ' A' ' 10' ' ' ILE . 3.8 mm? -53.73 -46.32 70.81 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.432 0.693 . . . . 0.0 110.496 174.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.2 mm-40 -55.03 -46.82 75.31 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 124.172 0.92 . . . . 0.0 111.016 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' THR . 16.0 mm-40 -70.5 -52.16 23.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.109 -174.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -68.93 -35.03 76.33 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -97.48 -6.58 33.44 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 64.34 36.9 8.8 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.329 1.052 . . . . 0.0 112.076 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -132.83 -175.48 3.79 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.711 0.404 . . . . 0.0 110.642 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -133.76 127.64 33.2 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 122.626 0.37 . . . . 0.0 110.917 172.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.22 129.9 36.68 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.134 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.429 ' O ' HG13 ' A' ' 62' ' ' ILE . 21.5 t70 -77.16 148.52 35.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.101 0.56 . . . . 0.0 110.37 -175.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.48 -43.21 71.53 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.137 0.975 . . . . 0.0 112.288 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.87 -12.06 61.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.838 0.855 . . . . 0.0 113.015 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -107.47 -15.74 14.54 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 117.918 0.326 . . . . 0.0 110.909 174.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 58' ' ' ASP . 52.3 mt -74.98 106.53 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 173.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.8 t -126.48 171.28 11.18 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.634 1.173 . . . . 0.0 109.346 173.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -70.08 -26.7 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 121.137 0.494 . . . . 0.0 109.95 168.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -70.37 -10.7 59.77 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.053 0.941 . . . . 0.0 111.488 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.465 HG22 HD13 ' A' ' 73' ' ' LEU . 56.1 m -72.46 -38.1 68.33 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.907 0.483 . . . . 0.0 109.802 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.593 ' HA ' HD21 ' A' ' 73' ' ' LEU . 74.6 m-85 -99.11 9.24 43.88 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -175.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.18 -44.86 96.63 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.246 0.341 . . . . 0.0 110.921 -176.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 49.6 p -137.28 159.6 41.45 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.923 0.889 . . . . 0.0 110.225 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.1 tp -59.96 -34.17 72.91 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 123.871 0.732 . . . . 0.0 111.127 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.27 -40.39 98.53 Favored Glycine 0 C--N 1.349 1.256 0 O-C-N 124.518 1.136 . . . . 0.0 112.194 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.414 ' O ' ' HD1' ' A' ' 76' ' ' PHE . 38.9 m -60.84 -50.74 72.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.32 0.648 . . . . 0.0 110.845 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.593 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -58.0 -45.24 87.14 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 123.257 0.348 . . . . 0.0 110.492 176.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.608 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -56.49 -44.1 80.32 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 124.667 1.229 . . . . 0.0 110.392 -179.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.2 -52.0 64.74 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 124.422 1.076 . . . . 0.0 110.277 177.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 31.6 m-85 -54.91 -58.97 5.46 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.118 0.886 . . . . 0.0 110.966 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 73' ' ' LEU . 29.5 m -66.4 -24.08 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.416 0.686 . . . . 0.0 112.791 -176.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 63.3 mm-40 -59.97 -52.13 66.73 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 169.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -65.5 -41.61 93.03 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.012 -172.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.469 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 27.7 mmmt -73.63 -43.93 58.29 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 123.762 0.663 . . . . 0.0 111.741 -172.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.87 -17.01 56.31 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 122.673 0.389 . . . . 0.0 111.548 -177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 62.2 m -88.63 -44.56 10.53 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.975 0.417 . . . . 0.0 111.285 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 69.1 m80 . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.232 -171.75 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.544 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -36.43 9.92 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.39 1.076 . . . . 0.0 110.739 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -75.74 -12.25 60.15 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.05 0.94 . . . . 0.0 112.941 -168.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -54.91 -30.93 59.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.844 0.715 . . . . 0.0 111.872 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.44 -44.76 70.63 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.885 0.874 . . . . 0.0 110.709 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.421 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -70.09 -32.06 69.94 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 177.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.69 -47.58 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 122.963 0.505 . . . . 0.0 109.93 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.541 ' HA ' HD12 ' A' ' 11' ' ' LEU . 31.4 ptt180 -68.08 -29.94 69.01 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.383 0.427 . . . . 0.0 109.999 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.569 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.4 t30 -60.89 -46.31 91.15 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.473 0.709 . . . . 0.0 110.025 174.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.475 HG21 HD22 ' A' ' 49' ' ' LEU . 86.1 mt -60.83 -44.8 98.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.418 176.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' A' ' 8' ' ' ARG . 39.9 mt -62.14 -38.17 87.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.061 0.544 . . . . 0.0 111.066 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.587 ' HA2' ' HB2' ' A' ' 17' ' ' LEU . . . -73.34 -25.91 71.68 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.145 -0.48 . . . . 0.0 113.481 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -73.35 -51.3 17.92 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.649 0.78 . . . . 0.0 110.554 177.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.7 t -77.18 -55.32 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.669 -173.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.483 HD11 HD13 ' A' ' 37' ' ' LEU . 33.7 mt -84.02 -4.12 58.51 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.966 -171.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 68.16 44.46 1.41 Allowed 'General case' 0 C--N 1.36 1.026 0 C-N-CA 124.694 1.197 . . . . 0.0 111.474 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 9.9 mp -73.61 -36.31 65.47 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.298 174.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 65.6 -87.1 0.09 OUTLIER Glycine 0 C--N 1.354 1.549 0 O-C-N 123.829 0.706 . . . . 0.0 112.659 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.23 -28.14 19.05 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.52 0.728 . . . . 0.0 111.123 177.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.486 HH11 HD23 ' A' ' 24' ' ' LEU . 2.0 tmt_? -67.31 -22.92 65.61 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.937 0.895 . . . . 0.0 110.411 -173.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 55.3 pttt -67.25 -29.29 68.88 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.028 0.531 . . . . 0.0 111.139 176.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -95.09 -18.96 20.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.452 0.701 . . . . 0.0 110.658 -173.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.405 HG22 ' O ' ' A' ' 20' ' ' ARG . 5.9 t -81.43 -10.98 59.4 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.732 0.413 . . . . 0.0 111.121 176.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.486 HD23 HH11 ' A' ' 20' ' ' ARG . 4.1 pp -102.66 152.8 20.78 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.813 0.445 . . . . 0.0 110.571 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.7 p -122.97 -171.63 2.33 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.485 1.114 . . . . 0.0 110.095 -174.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.73 67.57 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.308 0.643 . . . . 0.0 112.357 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.1 m -74.86 -26.71 59.87 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.614 0.766 . . . . 0.0 112.171 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 86.5 p -63.28 131.48 48.49 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 122.938 0.495 . . . . 0.0 111.34 -172.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.8 t -77.03 149.17 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.508 ' HA ' HG12 ' A' ' 34' ' ' ILE . 68.2 mt -111.17 -67.9 0.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.6 mt -57.92 112.13 1.39 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.601 0.36 . . . . 0.0 110.328 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 99.1 -28.93 13.01 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 115.426 -0.806 . . . . 0.0 113.569 177.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -88.62 -47.48 8.25 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 117.254 0.527 . . . . 0.0 110.63 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 30' ' ' LEU . 27.9 mm -76.25 115.74 49.78 Favored Pre-proline 0 N--CA 1.472 0.64 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 177.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.91 -5.14 16.43 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 122.381 2.054 . . . . 0.0 112.856 -174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -107.13 -0.24 22.95 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.461 0.704 . . . . 0.0 110.911 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.483 HD13 HD11 ' A' ' 15' ' ' LEU . 39.1 tp -94.74 80.29 3.76 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.466 0.65 . . . . 0.0 109.529 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 42' ' ' VAL . 3.8 p30 -95.97 -165.88 1.35 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.273 1.029 . . . . 0.0 110.275 176.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.623 ' O ' HG22 ' A' ' 42' ' ' VAL . 35.5 t -52.98 -69.58 0.11 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 125.391 1.476 . . . . 0.0 113.05 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 15.5 mmt -66.0 -23.84 66.65 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.793 -0.567 . . . . 0.0 111.388 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.63 83.6 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 175.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 39' ' ' SER . 15.1 m -66.99 -35.75 75.44 Favored 'Isoleucine or valine' 0 C--N 1.372 1.549 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.483 HG21 H312 ' A' ' 84' ' ' PNS . 7.2 t -65.0 -41.42 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 121.503 0.668 . . . . 0.0 110.701 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -61.93 -46.96 87.04 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 114.445 -1.252 . . . . 0.0 112.089 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.1 m -70.16 -28.99 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 CA-C-O 119.194 -0.431 . . . . 0.0 111.669 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.461 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 84.2 mt -59.0 -55.51 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 172.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.412 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 52.3 m -57.62 -42.46 83.34 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.918 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -38.77 90.89 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.941 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.475 HD22 HG21 ' A' ' 10' ' ' ILE . 2.4 mm? -56.98 -48.51 78.24 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.8 mm-40 -52.09 -50.91 60.69 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.491 1.119 . . . . 0.0 110.656 177.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 47' ' ' THR . 61.8 mm-40 -63.66 -58.12 7.91 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.642 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -69.47 -35.54 75.7 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -170.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -89.89 -13.6 36.02 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 176.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.13 49.18 2.74 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.088 0.955 . . . . 0.0 111.357 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -143.49 -169.48 3.07 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.087 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.0 t -138.01 131.26 30.45 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.959 0.503 . . . . 0.0 110.664 172.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.0 t -90.89 129.97 40.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 168.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.453 ' O ' HG13 ' A' ' 62' ' ' ILE . 36.2 t70 -74.79 148.39 40.39 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -65.84 -28.41 68.96 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.606 0.363 . . . . 0.0 111.789 -174.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.08 -29.25 66.2 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.71 0.804 . . . . 0.0 111.109 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -94.14 -13.48 26.69 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 122.623 0.369 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 58' ' ' ASP . 61.7 mt -75.7 107.82 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 172.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.5 t -115.7 167.31 11.03 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.933 0.893 . . . . 0.0 109.636 173.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.44 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -65.24 -31.83 73.18 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 165.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -71.26 -10.98 60.65 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.449 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.453 HG22 HD13 ' A' ' 73' ' ' LEU . 41.1 m -79.21 -41.38 28.44 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.585 ' HA ' HD21 ' A' ' 73' ' ' LEU . 43.2 m-85 -99.0 11.95 37.44 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.711 0.804 . . . . 0.0 113.048 -174.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.557 ' HG3' HG22 ' A' ' 69' ' ' THR . 10.4 pt-20 -61.22 -44.62 96.98 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.294 0.638 . . . . 0.0 111.749 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.557 HG22 ' HG3' ' A' ' 68' ' ' GLU . 8.0 t -148.0 158.68 44.18 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 110.229 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.37 -35.89 70.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.572 0.749 . . . . 0.0 111.434 -178.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.87 -42.07 96.47 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.492 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.6 m -63.95 -47.31 80.96 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.295 0.638 . . . . 0.0 111.44 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.585 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.6 mm? -57.53 -45.03 85.5 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -58.49 -44.79 89.54 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.835 1.334 . . . . 0.0 110.899 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -58.73 -51.12 71.33 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 123.972 0.795 . . . . 0.0 110.645 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 22.7 m-85 -56.08 -55.34 34.17 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.056 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.74 -24.97 31.6 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 123.055 0.542 . . . . 0.0 111.774 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 67.3 mm-40 -56.49 -56.88 15.71 Favored 'General case' 0 C--N 1.365 1.248 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -59.85 -46.35 89.55 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.196 0.935 . . . . 0.0 111.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.7 mmmt -57.97 -55.81 30.1 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.365 1.066 . . . . 0.0 112.034 -176.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.29 -13.71 59.73 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.876 -175.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.1 m -78.47 -20.52 50.73 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 117.953 0.342 . . . . 0.0 111.445 173.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.313 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.545 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.457 ' HG3' ' HG3' ' A' ' 78' ' ' GLU . 1.9 tpt . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.99 -36.74 65.73 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -163.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' ' 7' ' ' VAL . 11.0 m-70 -73.5 -9.31 58.56 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.412 -173.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.7 -32.62 59.75 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.133 0.573 . . . . 0.0 110.166 173.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -67.56 -52.03 43.54 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.466 -176.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.46 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.32 -35.01 75.51 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.14 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 3' ' ' HIS . 97.5 t -66.18 -47.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 122.585 0.354 . . . . 0.0 110.361 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.479 ' HA ' HD12 ' A' ' 11' ' ' LEU . 36.2 ptt180 -69.88 -27.18 64.6 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.646 0.378 . . . . 0.0 110.431 -178.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -61.63 -45.66 93.12 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.222 173.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 6' ' ' ALA . 92.8 mt -64.09 -46.33 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.58 1.152 . . . . 0.0 111.508 177.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 8' ' ' ARG . 52.1 mt -61.58 -43.03 99.61 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.321 0.648 . . . . 0.0 110.966 -177.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.11 -19.14 77.66 Favored Glycine 0 C--O 1.216 -1.017 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.056 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -75.09 -42.18 57.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 110.232 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 79.9 t -83.14 -46.23 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.26 -172.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -99.02 1.07 45.06 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.896 0.478 . . . . 0.0 111.991 -177.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.7 t30 60.05 63.19 1.48 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.86 1.264 . . . . 0.0 111.367 173.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.476 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 10.0 mp -81.49 -29.67 33.58 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.764 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 72.77 -105.94 1.85 Allowed Glycine 0 C--N 1.348 1.215 0 O-C-N 123.555 0.535 . . . . 0.0 112.35 176.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.6 -24.23 36.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.261 0.624 . . . . 0.0 110.443 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.567 HH11 HD23 ' A' ' 24' ' ' LEU . 2.3 tmt_? -64.78 -35.4 80.98 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.654 0.781 . . . . 0.0 109.66 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 52.6 pttt -67.08 -23.34 65.84 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.525 0.515 . . . . 0.0 111.549 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -94.59 -42.72 8.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 122.634 0.374 . . . . 0.0 110.724 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 20' ' ' ARG . 14.5 t -75.51 3.96 8.38 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.489 0.716 . . . . 0.0 112.43 -172.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.567 HD23 HH11 ' A' ' 20' ' ' ARG . 3.1 pp -95.97 -179.79 4.81 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.758 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 45.3 p -133.12 -171.94 2.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.564 1.146 . . . . 0.0 109.124 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.1 66.3 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.45 0.7 . . . . 0.0 111.728 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.5 m -75.61 -5.42 45.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.984 0.914 . . . . 0.0 111.997 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 24' ' ' LEU . 29.2 t -71.0 130.47 41.66 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.928 0.491 . . . . 0.0 110.674 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.0 t -87.13 138.43 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.473 ' HA ' HG12 ' A' ' 34' ' ' ILE . 59.6 mt -105.62 -71.58 0.74 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.892 0.477 . . . . 0.0 111.304 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 71.1 mt -53.96 118.98 4.43 Favored 'General case' 0 C--N 1.355 0.819 0 O-C-N 123.705 0.628 . . . . 0.0 111.02 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.43 -41.65 3.1 Favored Glycine 0 C--N 1.342 0.869 0 O-C-N 123.967 0.792 . . . . 0.0 113.401 177.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -72.14 -48.63 42.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.655 0.782 . . . . 0.0 111.19 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.473 HG12 ' HA ' ' A' ' 30' ' ' LEU . 35.3 mm -73.69 116.99 57.21 Favored Pre-proline 0 CA--C 1.545 0.758 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -74.15 -0.24 9.33 Favored 'Trans proline' 0 C--N 1.369 1.653 0 C-N-CA 122.8 2.333 . . . . 0.0 113.224 -175.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.417 ' H ' HG22 ' A' ' 34' ' ' ILE . 13.6 mm-40 -107.93 -2.4 19.81 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.915 0.886 . . . . 0.0 110.525 178.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 tt -106.19 102.59 11.99 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -175.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -112.48 -164.53 0.92 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.487 1.115 . . . . 0.0 110.583 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.545 ' O ' HG22 ' A' ' 42' ' ' VAL . 45.0 t -45.38 -67.67 0.26 Allowed 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 126.668 1.987 . . . . 0.0 113.231 171.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 22.3 mmt -62.48 -25.97 68.28 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 112.032 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 45' ' ' VAL . . . -64.99 -38.69 91.79 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 118.874 -0.584 . . . . 0.0 112.276 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.545 HG22 ' O ' ' A' ' 39' ' ' SER . 2.5 m -61.11 -38.45 79.66 Favored 'Isoleucine or valine' 0 C--N 1.368 1.406 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 176.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.557 HG21 H312 ' A' ' 84' ' ' PNS . 10.6 t -69.58 -45.43 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.771 -177.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -57.59 -42.72 83.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.124 -1.398 . . . . 0.0 112.077 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 41' ' ' ALA . 21.2 m -78.91 -28.03 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.492 -0.766 . . . . 0.0 112.175 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 95.6 mt -59.83 -55.59 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 171.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.426 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 30.1 m -54.52 -48.7 71.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.921 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.07 99.12 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.057 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -54.87 -51.66 65.25 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 123.283 0.633 . . . . 0.0 109.831 175.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.8 mm-40 -54.01 -44.2 70.7 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.471 1.108 . . . . 0.0 111.181 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 47' ' ' THR . 13.1 mm-40 -63.25 -64.15 0.99 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.71 -179.125 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -61.98 -41.43 98.01 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.703 0.801 . . . . 0.0 113.049 -170.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.419 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 65.2 m-85 -88.0 -21.32 24.89 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 118.962 -0.542 . . . . 0.0 112.016 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 63.88 58.95 1.17 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.18 0.992 . . . . 0.0 111.113 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -147.38 -177.19 5.56 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.003 -0.998 . . . . 0.0 109.749 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.2 t -131.1 117.9 19.77 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.531 0.333 . . . . 0.0 111.014 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.6 t -76.8 124.89 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 168.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 34.1 t70 -65.6 135.92 55.68 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.597 0.359 . . . . 0.0 110.315 -176.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -60.83 -27.58 68.18 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.243 0.617 . . . . 0.0 112.037 -173.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -82.07 -19.0 41.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.302 0.641 . . . . 0.0 112.272 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.2 pt-20 -92.29 -19.67 21.91 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 176.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 58' ' ' ASP . 57.7 mt -72.84 113.51 10.58 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 39.2 t -129.5 175.62 8.64 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 125.066 1.346 . . . . 0.0 108.389 175.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.45 -30.24 70.55 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 168.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -72.57 -13.6 61.43 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.603 0.761 . . . . 0.0 111.758 177.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 49.5 m -78.31 -32.42 49.27 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.054 0.542 . . . . 0.0 109.625 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.491 ' HA ' HD21 ' A' ' 73' ' ' LEU . 59.1 m-85 -108.94 7.16 25.83 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.633 0.773 . . . . 0.0 112.998 -177.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.96 -40.53 95.14 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 117.655 0.207 . . . . 0.0 111.043 -176.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.7 p -135.65 163.86 29.18 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.727 0.811 . . . . 0.0 110.241 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.48 -35.83 78.76 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.582 173.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.42 -30.99 75.79 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.026 0.829 . . . . 0.0 112.68 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.4 m -67.92 -51.73 44.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.353 0.661 . . . . 0.0 110.458 176.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.92 -46.99 86.62 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 122.915 0.134 . . . . 0.0 110.864 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -52.74 -50.39 63.55 Favored 'General case' 0 C--O 1.211 -0.932 0 O-C-N 124.596 1.185 . . . . 0.0 109.742 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.32 -56.48 18.09 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.582 1.153 . . . . 0.0 110.426 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.461 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 27.4 m-85 -57.21 -54.76 43.08 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.95 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 17.2 m -67.79 -25.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.048 0.539 . . . . 0.0 111.616 -176.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 69.1 mm-40 -60.56 -46.65 89.42 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 171.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -59.03 -50.74 72.94 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 123.518 0.511 . . . . 0.0 110.665 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.0 mmmt -63.48 -50.99 67.5 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.715 -170.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.12 -13.93 60.9 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.155 0.582 . . . . 0.0 112.157 -177.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.3 m -89.63 -1.37 58.0 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.69 0.396 . . . . 0.0 111.553 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 . . . . . 0 N--CA 1.48 1.027 0 C-N-CA 123.831 0.852 . . . . 0.0 109.145 175.367 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.557 H312 HG21 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.22 0.533 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.439 HE21 ' H ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -99.24 -34.48 10.32 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.096 0.959 . . . . 0.0 110.394 170.421 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.406 ' O ' HG23 ' A' ' 7' ' ' VAL . 15.7 m-70 -75.06 -20.05 59.72 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -53.71 -28.95 36.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 123.57 0.543 . . . . 0.0 111.898 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -65.26 -48.38 73.41 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 123.514 0.726 . . . . 0.0 111.083 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.13 -30.81 62.48 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.169 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 3' ' ' HIS . 91.7 t -65.08 -46.6 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 39.6 ptt180 -74.56 -24.89 59.0 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 122.988 0.515 . . . . 0.0 110.641 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.431 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 48.7 t30 -61.45 -47.04 87.55 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 172.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.403 HG21 HD22 ' A' ' 49' ' ' LEU . 93.6 mt -62.35 -45.66 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.955 176.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.41 -42.9 98.76 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.797 0.439 . . . . 0.0 110.961 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -70.58 -18.93 76.01 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.206 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -81.85 -52.49 7.05 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.053 0.541 . . . . 0.0 111.161 174.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.9 t -68.05 -57.99 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.321 0.648 . . . . 0.0 109.84 -175.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.471 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.0 mm? -81.21 -10.93 59.53 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 123.649 0.593 . . . . 0.0 111.272 -176.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 66.65 47.94 1.51 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.454 1.102 . . . . 0.0 110.868 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 3.5 mm? -66.53 -34.38 77.79 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 171.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.95 -93.27 0.15 Allowed Glycine 0 C--N 1.355 1.588 0 O-C-N 123.938 0.774 . . . . 0.0 112.988 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -79.19 -34.52 42.95 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.353 1.061 . . . . 0.0 110.413 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' HA ' HG22 ' A' ' 23' ' ' THR . 1.7 tmt_? -68.58 -25.34 64.84 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.577 -171.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HD3' ' HA3' ' A' ' 12' ' ' GLY . 56.1 pttt -64.98 -29.06 69.96 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 120.476 0.179 . . . . 0.0 111.33 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -85.53 -29.9 23.84 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 122.864 0.465 . . . . 0.0 110.982 -175.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 20' ' ' ARG . 12.1 t -84.37 -9.86 58.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.045 0.538 . . . . 0.0 111.819 -176.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 pp -94.22 151.79 19.19 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 177.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.0 p -112.67 -173.54 2.27 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.809 0.844 . . . . 0.0 109.938 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.58 -23.62 66.11 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.042 0.537 . . . . 0.0 111.332 172.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.3 m -81.16 0.98 33.93 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.26 1.024 . . . . 0.0 112.734 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.7 t -81.94 137.7 35.12 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.653 0.381 . . . . 0.0 110.651 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -86.91 145.76 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 124.331 1.052 . . . . 0.0 109.188 175.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.4 mt -108.18 -70.68 0.79 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.233 0.613 . . . . 0.0 110.676 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.483 HD23 HD12 ' A' ' 37' ' ' LEU . 21.4 mt -51.3 113.99 1.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.243 1.017 . . . . 0.0 112.269 178.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 83.49 -27.93 4.03 Favored Glycine 0 C--N 1.348 1.202 0 O-C-N 123.942 0.777 . . . . 0.0 114.059 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -76.7 -59.74 2.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.319 0.648 . . . . 0.0 109.915 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.439 HG22 ' H ' ' A' ' 36' ' ' GLU . 43.9 mm -70.84 121.98 85.49 Favored Pre-proline 0 CA--C 1.545 0.783 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 173.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -69.37 -9.22 25.67 Favored 'Trans proline' 0 C--N 1.376 1.984 0 C-N-CA 122.653 2.235 . . . . 0.0 112.452 -175.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 16.6 mm-40 -94.48 -21.87 18.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.831 0.853 . . . . 0.0 110.528 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.483 HD12 HD23 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -82.45 80.77 8.52 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -174.191 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 11.3 t70 -112.55 -168.45 1.32 Allowed 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 125.204 1.402 . . . . 0.0 109.516 -177.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.2 t -51.06 -70.42 0.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 125.751 1.621 . . . . 0.0 114.486 -173.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.8 mmm -65.0 -22.06 66.94 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.632 -0.667 . . . . 0.0 111.251 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.471 ' HB1' HD11 ' A' ' 15' ' ' LEU . . . -67.07 -35.96 80.96 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.481 0.713 . . . . 0.0 111.932 174.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -64.54 -37.9 81.24 Favored 'Isoleucine or valine' 0 C--N 1.372 1.545 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.504 HG21 H312 ' A' ' 84' ' ' PNS . 19.1 t -67.66 -44.33 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.684 -179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -61.7 -38.85 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 114.132 -1.394 . . . . 0.0 112.532 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.416 ' O ' HD23 ' A' ' 49' ' ' LEU . 30.1 m -80.1 -29.15 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.097 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.559 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -59.8 -57.06 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 171.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.9 m -55.72 -44.39 77.43 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.624 1.202 . . . . 0.0 111.37 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.49 -47.79 84.13 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.003 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 45' ' ' VAL . 3.2 mm? -52.17 -49.75 63.18 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.424 0.69 . . . . 0.0 110.174 174.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 3.9 mm-40 -57.47 -43.25 83.89 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.994 0.918 . . . . 0.0 111.368 -179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -67.08 -52.45 41.93 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.785 0.834 . . . . 0.0 112.59 -176.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -69.57 -39.35 77.42 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.404 ' HB2' ' CD1' ' A' ' 55' ' ' PHE . 72.7 m-85 -91.03 -16.8 27.32 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 57.97 64.27 1.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 124.611 1.164 . . . . 0.0 111.11 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.404 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -149.24 -176.36 5.34 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.679 0.792 . . . . 0.0 109.622 178.156 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -134.89 116.73 15.08 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 122.357 0.263 . . . . 0.0 111.421 171.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.556 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 4.8 t -69.34 127.85 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 168.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.466 ' O ' HG13 ' A' ' 62' ' ' ILE . 32.0 t70 -72.41 142.86 48.68 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 118.142 0.428 . . . . 0.0 110.767 -173.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -50.3 -44.65 54.1 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.521 1.128 . . . . 0.0 112.592 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -68.7 -21.76 64.39 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.107 -174.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 12.3 pt-20 -97.98 -20.97 17.09 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.157 0.183 . . . . 0.0 110.909 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 58' ' ' ASP . 60.9 mt -75.47 117.48 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 0.0 110.264 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 t -144.37 179.59 7.15 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 124.117 0.967 . . . . 0.0 109.491 174.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.414 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -60.22 -34.7 74.02 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.71 0.804 . . . . 0.0 110.151 167.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -67.84 -17.15 64.41 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.965 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -81.11 -37.82 28.27 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.453 0.701 . . . . 0.0 110.024 174.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.504 ' HA ' HD21 ' A' ' 73' ' ' LEU . 39.2 m-85 -104.85 14.7 29.11 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.28 0.632 . . . . 0.0 112.402 -176.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.54 -46.14 89.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.65 0.38 . . . . 0.0 110.605 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.3 p -137.28 158.41 44.49 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.638 0.775 . . . . 0.0 110.43 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.3 tp -55.41 -39.72 70.56 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.504 0.722 . . . . 0.0 110.71 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.46 95.76 Favored Glycine 0 C--N 1.347 1.176 0 O-C-N 124.452 1.095 . . . . 0.0 112.474 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.0 m -60.09 -45.31 93.38 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 122.787 0.435 . . . . 0.0 110.978 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.2 mm? -62.86 -42.18 99.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 122.999 0.187 . . . . 0.0 110.759 175.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.564 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -59.16 -49.03 79.42 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 124.153 0.908 . . . . 0.0 111.03 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.84 -43.74 92.07 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.634 0.774 . . . . 0.0 110.696 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.517 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 7.1 m-85 -58.08 -52.0 67.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 119.235 -0.412 . . . . 0.0 110.587 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.3 m -70.88 -24.73 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.003 0.521 . . . . 0.0 111.975 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 78.6 mm-40 -56.71 -44.85 81.99 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 168.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -73.19 -39.42 65.6 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.307 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.556 ' HE2' ' HA ' ' A' ' 57' ' ' VAL . 32.5 mmmt -64.91 -53.0 53.39 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.481 0.712 . . . . 0.0 111.912 -173.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.07 -13.1 60.45 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.436 -177.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.8 m -109.66 20.98 17.51 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.78 0.832 . . . . 0.0 111.845 172.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -172.662 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.504 H312 HG21 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.618 0.247 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -98.02 -37.82 9.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.009 0.923 . . . . 0.0 110.323 172.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -75.14 -12.98 60.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.992 0.917 . . . . 0.0 113.102 -169.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -57.67 -22.13 44.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 123.541 0.526 . . . . 0.0 111.689 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.3 -58.98 6.18 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.265 1.026 . . . . 0.0 110.926 176.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.66 58.82 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.783 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 87.4 t -63.53 -54.84 27.41 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -69.28 -28.04 65.95 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.289 0.236 . . . . 0.0 110.516 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -60.1 -52.57 64.77 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.319 0.647 . . . . 0.0 109.906 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.434 HG21 HD22 ' A' ' 49' ' ' LEU . 92.6 mt -64.05 -51.9 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.997 -178.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.413 HD13 HD13 ' A' ' 30' ' ' LEU . 76.7 mt -61.05 -39.63 90.57 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.074 0.55 . . . . 0.0 111.59 -175.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.571 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.1 -23.94 70.24 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 121.329 -0.462 . . . . 0.0 113.366 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.34 -27.01 38.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.033 0.533 . . . . 0.0 110.915 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.2 t -86.28 -59.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.336 0.655 . . . . 0.0 109.644 177.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.462 HD11 ' HB1' ' A' ' 41' ' ' ALA . 2.1 mm? -77.38 3.77 12.42 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -174.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 71.5 38.01 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.293 1.037 . . . . 0.0 111.192 167.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.412 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.6 mp -75.78 -32.08 59.77 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.165 172.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.5 -95.9 0.27 Allowed Glycine 0 C--N 1.353 1.51 0 O-C-N 123.556 0.535 . . . . 0.0 113.224 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -90.11 -25.29 20.8 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.025 0.93 . . . . 0.0 110.897 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' NH1' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -63.11 -26.82 69.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.574 0.749 . . . . 0.0 111.348 -175.523 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.8 pttt -66.26 -30.32 70.73 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.041 0.537 . . . . 0.0 111.731 178.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -81.91 -22.3 36.87 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.513 0.725 . . . . 0.0 111.081 -175.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 t -93.49 2.62 56.38 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.836 0.454 . . . . 0.0 112.054 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.439 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 4.2 pp -108.06 159.06 16.87 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.951 -0.468 . . . . 0.0 110.743 176.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -116.26 -174.92 2.64 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.663 0.785 . . . . 0.0 110.915 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -67.3 -17.69 64.88 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.28 0.632 . . . . 0.0 111.933 175.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -74.23 -24.03 59.25 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.34 0.656 . . . . 0.0 111.46 173.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.1 t -63.54 125.43 24.22 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.712 0.805 . . . . 0.0 111.455 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.8 t -79.23 147.14 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.413 HD13 HD13 ' A' ' 11' ' ' LEU . 67.5 mt -116.43 -68.14 0.94 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.241 0.616 . . . . 0.0 110.07 -177.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 tt -61.86 111.23 1.8 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.54 -26.95 22.67 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.461 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -88.92 -49.89 6.52 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 117.321 0.56 . . . . 0.0 110.671 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.4 mm -81.35 118.48 72.46 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.93 -6.68 18.4 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.686 2.257 . . . . 0.0 112.848 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -94.24 -18.14 21.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.88 0.872 . . . . 0.0 111.06 -175.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.5 tp -86.66 88.52 7.68 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 122.917 0.487 . . . . 0.0 109.719 -174.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.518 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 13.0 t70 -120.76 -170.68 2.04 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 124.045 0.938 . . . . 0.0 109.66 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.6 ' O ' HG22 ' A' ' 42' ' ' VAL . 38.1 t -40.27 -69.4 0.13 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 127.615 2.366 . . . . 0.0 114.883 -178.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -66.89 -29.76 69.74 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.211 -0.931 . . . . 0.0 111.761 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.518 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -66.79 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 39' ' ' SER . 28.6 m -70.42 -33.32 53.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.2 -46.79 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.509 0.671 . . . . 0.0 110.033 175.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -56.68 -48.71 77.04 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.27 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.409 HG22 ' HA ' ' A' ' 42' ' ' VAL . 27.6 m -72.45 -32.9 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.915 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.536 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.1 mt -60.01 -52.26 63.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 174.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 64.3 m -55.06 -44.61 74.93 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 124.579 1.175 . . . . 0.0 111.177 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -42.35 99.66 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.763 0.825 . . . . 0.0 111.883 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.434 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -57.82 -46.29 84.92 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.071 0.548 . . . . 0.0 110.232 173.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.8 mm-40 -54.46 -44.18 72.33 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.232 1.013 . . . . 0.0 110.827 178.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' THR . 43.4 mm-40 -63.01 -57.18 11.56 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.724 -176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -66.35 -44.91 81.93 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.604 0.565 . . . . 0.0 112.258 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -88.56 -9.46 52.21 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 118.941 -0.552 . . . . 0.0 112.359 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 59.47 45.28 13.78 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.271 1.028 . . . . 0.0 111.656 175.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -139.02 -177.02 4.7 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.425 -174.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.7 t -134.49 113.66 12.05 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.2 t -69.06 131.91 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 16.9 t70 -67.37 134.04 50.73 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.46 0.704 . . . . 0.0 110.158 -176.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -57.98 -38.42 76.05 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.886 0.875 . . . . 0.0 112.949 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -72.35 -20.18 61.51 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.938 0.495 . . . . 0.0 111.995 -176.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 18.3 pt-20 -98.71 -8.92 25.34 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.382 0.273 . . . . 0.0 110.641 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 51.5 mt -87.09 117.81 31.94 Favored 'Isoleucine or valine' 0 C--N 1.359 0.979 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 169.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.8 t -155.91 -172.3 4.07 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.308 1.043 . . . . 0.0 108.459 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.87 -36.85 77.75 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.719 0.408 . . . . 0.0 110.655 176.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 24.1 mm-40 -68.55 -12.26 61.04 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.149 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.48 HG22 HD13 ' A' ' 73' ' ' LEU . 23.2 m -81.29 -45.14 16.66 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.215 0.606 . . . . 0.0 109.606 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.542 ' HA ' HD21 ' A' ' 73' ' ' LEU . 70.0 m-85 -97.75 6.25 48.14 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -174.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.497 ' HG3' HG22 ' A' ' 69' ' ' THR . 8.7 pt-20 -57.03 -45.13 83.33 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.724 0.64 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.497 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -146.63 160.21 42.46 Favored 'General case' 0 C--O 1.249 1.058 0 C-N-CA 123.466 0.707 . . . . 0.0 110.036 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 17.3 tp -58.84 -35.66 73.27 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.774 0.83 . . . . 0.0 110.852 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.82 -42.14 96.4 Favored Glycine 0 C--N 1.349 1.276 0 O-C-N 124.635 1.209 . . . . 0.0 112.107 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.5 m -62.58 -49.45 75.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.974 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.4 mm? -57.69 -46.22 84.61 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.137 0.426 . . . . 0.0 110.196 178.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.561 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -61.46 -39.37 90.65 Favored 'General case' 0 C--O 1.217 -0.65 0 O-C-N 124.529 1.143 . . . . 0.0 111.305 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.78 -49.68 67.47 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.733 0.813 . . . . 0.0 110.621 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 42.4 m-85 -55.72 -49.67 72.42 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.55 0.531 . . . . 0.0 110.32 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.2 m -70.73 -25.66 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -55.69 -48.81 74.48 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -66.9 -41.27 87.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.146 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.3 mmmt -63.2 -54.1 42.84 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.65 0.78 . . . . 0.0 112.238 -173.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.44 -13.5 61.08 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.328 -175.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.1 m -97.41 -22.23 16.72 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.422 0.689 . . . . 0.0 111.45 174.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 . . . . . 0 CA--C 1.548 0.901 0 C-N-CA 123.963 0.905 . . . . 0.0 109.385 -174.502 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.613 ' SD ' ' HG3' ' A' ' 78' ' ' GLU . 7.1 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.445 HE21 ' N ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -98.23 -39.32 8.91 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 0.0 111.724 -175.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' HG23 ' A' ' 7' ' ' VAL . 41.7 m-70 -76.8 -10.97 59.75 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.24 -170.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -55.35 -31.88 62.08 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 118.664 0.666 . . . . 0.0 111.799 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -74.72 -41.54 59.98 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.447 0.699 . . . . 0.0 111.435 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.438 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -67.27 -37.22 83.09 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.959 176.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 3' ' ' HIS . 96.5 t -67.1 -47.3 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.052 178.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.41 ' HD2' ' O ' ' A' ' 21' ' ' LYS . 28.7 ptt180 -68.65 -25.93 65.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.563 0.345 . . . . 0.0 110.476 -179.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 23.8 t30 -61.86 -50.49 72.02 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.67 0.788 . . . . 0.0 109.531 173.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.558 HG21 HD22 ' A' ' 49' ' ' LEU . 91.5 mt -59.83 -42.72 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.651 1.18 . . . . 0.0 111.281 178.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 46.0 mt -68.96 -41.75 77.54 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.136 0.574 . . . . 0.0 111.056 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.461 ' HA3' ' HD3' ' A' ' 21' ' ' LYS . . . -71.91 -18.27 77.51 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 116.147 -0.478 . . . . 0.0 113.148 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -79.95 -53.75 6.45 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.848 0.859 . . . . 0.0 110.006 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.495 HG13 ' ND2' ' A' ' 44' ' ' ASN . 79.5 t -73.32 -49.54 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.09 0.956 . . . . 0.0 111.387 -173.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.413 ' HB3' ' HB2' ' A' ' 36' ' ' GLU . 0.9 OUTLIER -83.93 -3.09 57.69 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.269 0.228 . . . . 0.0 110.84 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 61.64 53.45 3.26 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 124.962 1.305 . . . . 0.0 111.214 172.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.446 ' HB2' ' HA2' ' A' ' 12' ' ' GLY . 7.8 mp -75.81 -28.16 58.22 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.8 171.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 64.46 -89.03 0.08 OUTLIER Glycine 0 C--N 1.353 1.491 0 O-C-N 124.211 0.944 . . . . 0.0 112.408 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -93.24 -29.34 15.74 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.827 0.851 . . . . 0.0 111.448 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -66.68 -26.35 66.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.99 0.516 . . . . 0.0 111.355 -170.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' HA ' ' A' ' 9' ' ' ASN . 58.1 pttt -58.57 -28.11 65.23 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.701 0.4 . . . . 0.0 111.569 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -79.08 -25.73 43.06 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.81 0.844 . . . . 0.0 110.957 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.1 t -93.81 1.46 56.44 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.614 0.366 . . . . 0.0 111.926 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 pp -109.72 151.46 26.89 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 121.895 -0.503 . . . . 0.0 110.038 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 55.8 p -123.51 -171.73 2.37 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.688 0.795 . . . . 0.0 109.996 -175.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.7 -20.3 65.94 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.442 0.697 . . . . 0.0 112.478 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 m -75.89 -21.74 56.83 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.193 0.597 . . . . 0.0 111.859 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -71.55 137.62 48.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.669 0.787 . . . . 0.0 111.422 -175.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.88 160.72 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 C-N-CA 124.573 1.149 . . . . 0.0 109.224 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.6 mt -117.1 -68.51 0.91 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.03 109.31 1.24 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.805 174.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.25 -34.27 5.81 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.273 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -77.27 -57.65 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.425 HG22 ' H ' ' A' ' 36' ' ' GLU . 12.9 mm -81.73 116.46 63.3 Favored Pre-proline 0 CA--C 1.543 0.708 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -175.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -77.18 -8.08 17.4 Favored 'Trans proline' 0 C--N 1.369 1.633 0 C-N-CA 122.459 2.106 . . . . 0.0 112.02 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.425 ' H ' HG22 ' A' ' 34' ' ' ILE . 6.0 mm-40 -96.48 -6.82 36.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.983 0.913 . . . . 0.0 110.659 -178.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.1 tp -81.72 80.76 7.97 Favored 'General case' 0 C--N 1.349 0.584 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.431 ' N ' ' HB3' ' A' ' 41' ' ' ALA . 22.3 t70 -82.01 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.476 1.511 . . . . 0.0 110.607 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' VAL . 48.1 t -43.95 -66.73 0.35 Allowed 'General case' 0 CA--C 1.566 1.577 0 C-N-CA 126.163 1.785 . . . . 0.0 112.469 170.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 95.0 mmm -70.56 -15.26 62.75 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 121.652 -0.655 . . . . 0.0 111.748 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.431 ' HB3' ' N ' ' A' ' 38' ' ' ASP . . . -77.22 -25.34 51.56 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.319 174.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' SER . 4.7 m -69.61 -37.99 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.12 -42.33 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.648 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.495 ' ND2' HG13 ' A' ' 14' ' ' VAL . 59.6 t30 -68.26 -37.75 81.07 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 114.479 -1.237 . . . . 0.0 112.553 -176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.2 m -72.53 -35.71 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.69 177.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.503 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 93.1 mt -59.97 -48.51 87.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 33.0 m -56.86 -45.06 82.72 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 124.373 1.046 . . . . 0.0 110.732 177.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.26 -41.65 98.63 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.689 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.558 HD22 HG21 ' A' ' 10' ' ' ILE . 3.4 mm? -56.58 -46.68 80.67 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.197 0.599 . . . . 0.0 109.9 176.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 6.2 mm-40 -51.66 -50.52 60.2 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.266 1.026 . . . . 0.0 110.386 176.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 47' ' ' THR . 19.2 mm-40 -59.81 -63.96 1.11 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.76 -176.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -65.05 -46.02 82.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.651 -169.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -87.67 -7.66 57.13 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.1 t70 65.19 36.41 7.17 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.93 0.892 . . . . 0.0 111.042 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.19 -175.53 3.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.413 0.685 . . . . 0.0 110.118 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -123.14 135.64 54.44 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 37.2 t -84.75 125.19 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 170.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' HG13 ' A' ' 62' ' ' ILE . 30.2 t70 -75.13 151.33 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.148 0.579 . . . . 0.0 111.083 -174.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -53.45 -41.76 66.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.406 1.082 . . . . 0.0 113.137 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -67.58 -17.96 64.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.836 0.854 . . . . 0.0 111.962 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -115.44 8.01 15.16 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.524 0.729 . . . . 0.0 111.436 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 58' ' ' ASP . 28.9 mt -98.41 105.44 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 77.5 p -146.27 173.23 12.43 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.645 0.778 . . . . 0.0 109.532 171.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.76 71.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 169.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.33 -21.1 66.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.147 0.579 . . . . 0.0 111.469 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 39.2 m -72.52 -40.31 66.89 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.259 0.624 . . . . 0.0 110.071 175.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.717 ' HA ' HD21 ' A' ' 73' ' ' LEU . 62.3 m-85 -97.43 18.32 15.55 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.634 0.774 . . . . 0.0 113.037 -174.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.533 ' HG3' HG22 ' A' ' 69' ' ' THR . 9.5 pt-20 -63.58 -46.34 86.29 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 122.681 0.392 . . . . 0.0 111.629 178.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.533 HG22 ' HG3' ' A' ' 68' ' ' GLU . 10.2 t -145.51 155.05 42.85 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 123.354 0.662 . . . . 0.0 110.531 -177.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.56 -32.73 67.41 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.724 0.81 . . . . 0.0 111.296 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.15 -41.68 98.25 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.953 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.2 m -60.4 -52.92 63.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.915 0.486 . . . . 0.0 110.33 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.717 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -61.34 -39.73 91.64 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 123.568 0.542 . . . . 0.0 110.938 -178.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.567 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -57.08 -49.68 75.1 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.424 1.077 . . . . 0.0 109.988 178.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.14 -39.46 89.86 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.708 0.63 . . . . 0.0 111.702 -177.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.508 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 34.9 m-85 -59.79 -54.75 42.64 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.7 m -67.1 -26.16 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 122.829 0.451 . . . . 0.0 111.787 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.613 ' HG3' ' SD ' ' A' ' 1' ' ' MET . 76.4 mm-40 -57.23 -51.9 67.49 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 170.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 47.9 m170 -63.01 -49.38 74.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.134 -175.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 32.1 mmmt -60.54 -55.15 36.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.784 0.834 . . . . 0.0 112.04 -172.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.59 -14.32 61.59 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.871 -176.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.4 m -89.52 -28.36 19.68 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.963 0.505 . . . . 0.0 111.442 173.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.6 m170 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.921 -0.562 . . . . 0.0 109.838 177.883 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.444 ' H36' H313 ' A' ' 84' ' ' PNS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.581 ' HG2' ' HB1' ' A' ' 74' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -96.88 -44.28 7.11 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 118.446 0.566 . . . . 0.0 112.067 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.423 ' HD2' ' HA ' ' A' ' 78' ' ' GLU . 82.6 m-70 -75.11 -12.86 60.4 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.939 -169.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.29 -31.2 63.43 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 118.216 0.462 . . . . 0.0 111.4 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -66.53 -52.88 41.0 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 125.006 1.322 . . . . 0.0 110.628 -178.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 10' ' ' ILE . . . -69.1 -32.25 71.54 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.506 -178.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 3' ' ' HIS . 86.5 t -68.43 -48.67 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.742 0.417 . . . . 0.0 110.354 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 40.7 ptt180 -67.55 -30.11 69.67 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.449 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 37.4 t30 -62.24 -46.64 87.92 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.531 0.733 . . . . 0.0 109.914 176.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 6' ' ' ALA . 69.8 mt -61.71 -56.38 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 O-C-N 124.366 1.041 . . . . 0.0 111.672 179.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.547 HD22 HD13 ' A' ' 30' ' ' LEU . 9.7 mp -64.83 -34.03 77.4 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.922 0.139 . . . . 0.0 111.351 -176.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.54 ' HA3' ' HB3' ' A' ' 21' ' ' LYS . . . -76.79 -18.22 79.1 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 119.813 -0.437 . . . . 0.0 113.309 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -79.28 -53.04 7.34 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.742 0.417 . . . . 0.0 110.289 174.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.73 -58.57 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.325 1.05 . . . . 0.0 109.829 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 37' ' ' LEU . 64.0 mt -77.15 -8.21 57.14 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.135 -175.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 62.57 62.94 1.05 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.475 1.11 . . . . 0.0 110.717 172.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 4.1 mm? -85.27 -27.96 25.64 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.587 170.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 21' ' ' LYS . . . 69.1 -107.5 2.12 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.873 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.33 -26.22 51.88 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.632 0.773 . . . . 0.0 111.147 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.574 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -62.68 -32.93 74.09 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.879 0.872 . . . . 0.0 110.068 -172.172 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.54 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . 63.5 pttt -64.37 -34.83 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.95 -177.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -89.49 -21.19 23.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.218 0.207 . . . . 0.0 110.499 -173.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.437 HG22 ' HA ' ' A' ' 20' ' ' ARG . 6.8 t -91.96 7.14 43.51 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.027 0.531 . . . . 0.0 110.94 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 pp -109.0 156.15 20.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.893 0.477 . . . . 0.0 109.77 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.9 p -111.88 -178.26 3.39 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.248 1.019 . . . . 0.0 110.709 -175.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.504 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . . . -66.53 -27.66 67.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.363 0.665 . . . . 0.0 111.315 177.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.4 p -78.32 -4.04 46.06 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.65 0.78 . . . . 0.0 112.419 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.9 t -80.6 141.01 35.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.137 0.575 . . . . 0.0 110.198 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.3 t -80.65 151.63 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.437 1.095 . . . . 0.0 109.026 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 11' ' ' LEU . 82.5 mt -118.58 -69.74 0.83 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.131 0.572 . . . . 0.0 109.929 177.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.7 tt -67.8 122.46 18.17 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 175.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.48 -34.78 5.04 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.006 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -86.32 -67.49 0.81 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.195 0.598 . . . . 0.0 111.014 -177.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.453 HG22 ' H ' ' A' ' 36' ' ' GLU . 37.2 mm -64.47 119.66 58.69 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 123.278 0.631 . . . . 0.0 109.981 -172.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -72.9 -6.38 18.91 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.719 2.279 . . . . 0.0 112.699 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.453 ' H ' HG22 ' A' ' 34' ' ' ILE . 22.4 mm-40 -96.48 -14.6 22.24 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.756 0.822 . . . . 0.0 110.872 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.524 HD23 HD11 ' A' ' 15' ' ' LEU . 3.1 tm? -84.93 85.29 7.49 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -178.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.493 ' H ' ' HB3' ' A' ' 41' ' ' ALA . 8.3 t70 -108.79 -173.19 2.21 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.377 1.071 . . . . 0.0 108.846 177.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.542 ' O ' HG22 ' A' ' 42' ' ' VAL . 39.8 t -49.37 -70.93 0.07 Allowed 'General case' 0 CA--C 1.57 1.742 0 C-N-CA 125.711 1.604 . . . . 0.0 114.5 -173.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 25.8 mmt -62.75 -25.58 68.27 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 121.708 -0.62 . . . . 0.0 111.358 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.493 ' HB3' ' H ' ' A' ' 38' ' ' ASP . . . -69.43 -29.53 67.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.312 0.645 . . . . 0.0 112.355 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 39' ' ' SER . 3.0 m -65.98 -40.5 87.53 Favored 'Isoleucine or valine' 0 C--N 1.37 1.478 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 172.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.525 HG21 H312 ' A' ' 84' ' ' PNS . 4.9 t -67.15 -40.43 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.463 -178.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -65.12 -43.12 92.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.272 . . . . 0.0 112.037 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 30.0 m -72.52 -33.13 44.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.089 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 96.7 mt -60.92 -48.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 173.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.463 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 68.1 m -55.77 -44.04 77.29 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 124.301 1.001 . . . . 0.0 110.528 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.85 -37.57 86.54 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.212 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.442 HD22 HG21 ' A' ' 10' ' ' ILE . 3.7 mm? -54.21 -50.63 66.66 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 172.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 4.4 mm-40 -54.89 -46.04 74.76 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.17 177.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 47' ' ' THR . 30.0 mm-40 -61.66 -60.58 3.46 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.061 0.944 . . . . 0.0 112.093 -177.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -66.91 -46.29 75.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -172.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.502 ' HB3' HD11 ' A' ' 81' ' ' LEU . 93.4 m-85 -84.1 -19.64 33.92 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-O 119.082 -0.485 . . . . 0.0 112.078 -177.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.56 47.74 1.59 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.248 1.019 . . . . 0.0 111.633 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.456 ' CD1' ' HB2' ' A' ' 53' ' ' PHE . 0.5 OUTLIER -137.6 -174.27 3.72 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.906 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.8 t -134.84 117.08 15.52 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 122.767 0.427 . . . . 0.0 110.962 172.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.424 ' HA ' ' HE2' ' A' ' 80' ' ' LYS . 11.7 t -68.96 132.79 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 173.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.423 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 33.5 t70 -76.26 147.08 38.53 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.592 0.357 . . . . 0.0 110.392 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -57.39 -42.34 81.98 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.199 0.599 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.08 -14.96 62.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.209 0.604 . . . . 0.0 112.289 -174.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 11.8 pt-20 -103.31 -11.34 17.99 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 119.386 -0.34 . . . . 0.0 110.864 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 54.5 mt -85.92 116.17 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.234 0.614 . . . . 0.0 110.392 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -145.85 -178.96 6.38 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.879 1.272 . . . . 0.0 108.849 171.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.473 ' HA ' ' S44' ' A' ' 84' ' ' PNS . . . -65.18 -34.37 78.22 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 171.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -71.94 -11.17 60.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.671 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 57.6 m -76.29 -36.67 58.25 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.226 0.61 . . . . 0.0 110.058 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.596 ' HA ' HD21 ' A' ' 73' ' ' LEU . 40.9 m-85 -99.79 14.76 29.18 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.948 0.499 . . . . 0.0 112.082 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -60.89 -45.62 93.86 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.432 0.293 . . . . 0.0 110.659 -178.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.0 p -138.04 163.59 31.22 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.784 0.833 . . . . 0.0 110.168 176.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.504 ' HB3' ' HA ' ' A' ' 26' ' ' ALA . 55.0 tp -59.29 -37.18 77.06 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.029 176.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.1 -34.3 89.57 Favored Glycine 0 C--N 1.34 0.753 0 CA-C-N 114.684 -1.144 . . . . 0.0 112.346 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -60.31 -54.89 40.24 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 122.859 0.464 . . . . 0.0 109.885 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 67' ' ' PHE . 3.3 mm? -58.96 -44.3 91.46 Favored 'General case' 0 C--N 1.366 1.29 0 O-C-N 124.025 0.828 . . . . 0.0 110.313 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 78' ' ' GLU . . . -54.5 -46.87 73.55 Favored 'General case' 0 C--O 1.217 -0.636 0 O-C-N 124.64 1.212 . . . . 0.0 110.969 -178.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.48 HD22 ' SD ' ' A' ' 1' ' ' MET . 3.6 mm? -65.87 -47.64 74.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.813 0.845 . . . . 0.0 111.346 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HG2' ' A' ' 80' ' ' LYS . 52.6 m-85 -56.39 -53.03 62.14 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.7 m -70.68 -23.81 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.653 0.781 . . . . 0.0 112.205 -177.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 75.0 mm-40 -54.19 -52.88 59.8 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -70.64 -29.6 66.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.989 -1.46 . . . . 0.0 112.114 -173.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 76' ' ' PHE . 31.9 mmmt -72.04 -58.09 3.73 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.478 0.711 . . . . 0.0 110.847 178.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 53' ' ' PHE . 3.9 mm? -68.2 -11.24 58.95 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.556 -176.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 55.3 m -55.26 -40.6 71.16 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.131 0.572 . . . . 0.0 111.113 167.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.3 m-70 . . . . . 0 C--O 1.253 1.239 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.169 178.054 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PNS . . . . . 0.525 H312 HG21 ' A' ' 43' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_