data_2mk6_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 2mk6 _Structure_validation_residue.Date_analyzed 2016-10-08 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 . . . . . . . . . . . . . 24.0 ptm . . . . . 0 N--CA 1.496 1.839 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -134.75 130.71 36.62 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.0 mm -122.31 152.24 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 125.057 1.343 . . . . 0.0 108.907 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.01 152.18 46.05 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.12 1.368 . . . . 0.0 110.121 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -119.59 92.61 3.83 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.038 1.735 . . . . 0.0 106.461 177.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.9 -53.51 40.8 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -157.28 -162.98 1.29 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.006 1.722 . . . . 0.0 108.24 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -67.48 -17.12 64.57 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -123.81 -50.26 1.84 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.411 -0.805 . . . . 0.0 110.852 -164.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 27.8 m -81.42 133.07 35.36 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 170.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -128.94 159.9 40.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 163.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.4 pttt -139.13 167.14 22.73 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 164.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -148.95 166.69 27.86 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -125.38 133.99 52.33 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 106.128 -1.805 . . . . 0.0 106.128 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.4 tpt -129.42 107.23 9.34 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -169.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.67 154.62 41.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.9 m-85 -53.52 -37.91 63.26 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.707 -0.621 . . . . 0.0 111.893 175.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.54 -26.08 74.85 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.304 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.81 -30.66 69.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.692 1.746 . . . . 0.0 110.316 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.97 -44.62 28.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -58.9 -39.82 82.62 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 124.835 1.254 . . . . 0.0 111.631 175.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.98 -44.16 97.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.96 0.886 . . . . 0.0 111.257 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 79.3 mtt85 -72.09 -5.6 36.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.677 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 11.64 85.02 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.719 1.152 . . . . 0.0 112.903 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -85.05 -175.09 5.61 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 168.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -135.33 146.54 48.54 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 173.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -52.86 -35.28 57.4 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.991 0.814 . . . . 0.0 111.119 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -80.39 -45.11 18.25 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.537 1.135 . . . . 0.0 108.967 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -61.18 -36.09 78.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.213 1.005 . . . . 0.0 112.319 -176.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.88 -49.87 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -84.21 -26.4 28.76 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -97.39 -17.08 19.92 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.937 0.495 . . . . 0.0 111.316 -167.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.8 -171.48 3.54 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 158.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -135.98 -48.01 0.67 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.186 -0.946 . . . . 0.0 111.136 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -34.64 76.54 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.369 0.668 . . . . 0.0 110.605 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -79.84 -12.54 59.75 Favored 'General case' 0 C--N 1.34 0.182 0 O-C-N 121.49 -0.756 . . . . 0.0 111.925 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.71 -41.5 75.26 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 168.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.577 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 15.7 tt0 -56.28 -30.98 63.19 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.128 1.371 . . . . 0.0 113.013 -171.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.76 -33.5 75.79 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.653 1.981 . . . . 0.0 111.033 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -44.88 92.24 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.577 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -71.12 -40.68 71.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.652 0.781 . . . . 0.0 108.958 -173.885 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -56.45 -40.44 74.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.369 171.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.05 -22.26 65.6 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.396 0.998 . . . . 0.0 113.08 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.3 m -103.99 -38.09 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 119.846 1.203 . . . . 0.0 111.853 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -43.27 64.68 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 163.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.86 -44.64 66.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 123.779 0.832 . . . . 0.0 112.441 173.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -62.62 -7.37 4.64 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 t -129.02 -2.95 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 126.059 1.744 . . . . 0.0 110.003 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -59.99 -29.88 68.75 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.515 -1.365 . . . . 0.0 114.517 -159.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.84 -11.69 40.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.413 0.685 . . . . 0.0 112.46 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -113.82 -31.73 6.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.229 1.812 . . . . 0.0 110.623 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.26 -28.27 67.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.415 1.007 . . . . 0.0 111.009 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.28 -22.31 40.7 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.139 0.881 . . . . 0.0 112.747 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -83.75 -10.65 57.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.904 0.775 . . . . 0.0 112.335 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -138.15 4.83 2.5 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.294 1.038 . . . . 0.0 113.581 -165.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.59 77.6 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-O 122.801 1.286 . . . . 0.0 109.033 174.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -147.82 22.88 1.11 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.918 1.287 . . . . 0.0 110.827 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.25 176.89 42.59 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.796 1.189 . . . . 0.0 110.435 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.74 164.69 33.12 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.798 2.999 . . . . 0.0 112.03 -174.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.1 mt -87.53 158.93 18.8 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 164.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -143.18 141.75 31.23 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.57 143.17 39.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.386 0.994 . . . . 0.0 108.727 -172.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -137.38 155.66 49.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.147 1.379 . . . . 0.0 107.718 165.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.91 160.21 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 O-C-N 120.744 -1.222 . . . . 0.0 110.178 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -141.05 152.15 44.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 157.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.0 143.59 30.95 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.131 0.573 . . . . 0.0 109.618 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -125.93 -175.6 3.4 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.255 2.622 . . . . 0.0 107.599 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.9 -35.54 80.38 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -164.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.6 mmtm -141.07 25.54 2.09 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 112.14 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.91 -173.45 42.49 Favored Glycine 0 C--O 1.228 -0.27 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -175.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.52 144.86 46.54 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.478 1.111 . . . . 0.0 108.82 177.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -94.54 129.49 41.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 161.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.95 127.24 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mp -95.8 147.09 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 166.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.97 139.99 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 172.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -134.94 168.47 19.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.097 0.959 . . . . 0.0 108.622 -173.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 mppt? . . . . . 0 N--CA 1.472 0.645 0 C-N-CA 124.505 1.122 . . . . 0.0 109.903 -178.47 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.737 0.303 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -124.98 77.95 1.66 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -160.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 mm -68.43 150.45 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.763 1.225 . . . . 0.0 109.327 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -151.66 102.25 2.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.355 1.062 . . . . 0.0 110.226 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -72.78 118.38 15.65 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.267 -1.521 . . . . 0.0 106.907 171.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 32.9 mm -81.92 -53.54 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -163.62 -175.14 4.01 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.894 1.677 . . . . 0.0 108.873 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.08 -14.99 1.81 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.366 1.467 . . . . 0.0 114.931 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -119.19 -27.26 5.71 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.265 1.426 . . . . 0.0 112.802 -167.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -129.81 140.79 50.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.457 1.103 . . . . 0.0 109.27 -172.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.8 m -130.07 153.64 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 106.219 -1.771 . . . . 0.0 106.219 166.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -132.29 168.31 18.31 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 168.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.447 ' CE1' HG22 ' A' ' 44' ' ' VAL . 40.8 p90 -155.0 165.17 37.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -118.69 140.91 49.17 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -132.38 112.13 11.91 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.9 m -73.19 156.97 38.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.1 m-85 -52.06 -43.44 63.81 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 121.985 -0.447 . . . . 0.0 111.745 173.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -78.81 -12.07 84.57 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 119.707 -1.235 . . . . 0.0 113.817 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -34.39 75.54 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.688 1.744 . . . . 0.0 109.422 165.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.15 -42.11 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -61.33 -37.54 83.65 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.735 0.698 . . . . 0.0 111.515 175.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.47 -42.51 98.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.838 0.828 . . . . 0.0 110.898 -176.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -72.39 -4.83 32.44 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.564 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.62 11.19 85.52 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.479 1.038 . . . . 0.0 113.071 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -82.86 -173.13 4.5 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 168.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -138.53 147.05 42.67 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 174.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.6 ptt85 -56.93 -35.5 69.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.676 0.671 . . . . 0.0 111.597 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.62 -45.52 29.8 Favored 'General case' 0 C--O 1.226 -0.147 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.97 -37.02 78.39 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 121.429 -0.795 . . . . 0.0 111.838 -172.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -53.32 -47.43 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.58 0.752 . . . . 0.0 109.947 171.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 m95 -68.64 -21.71 64.45 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.266 0.939 . . . . 0.0 112.943 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -120.56 4.06 10.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -161.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -137.87 83.56 1.99 Allowed 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -47.43 -42.77 23.06 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.58 -32.09 63.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.479 -0.763 . . . . 0.0 111.288 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -77.82 -19.66 54.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.95 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -51.96 64.89 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 166.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -52.42 -34.37 48.1 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.229 1.412 . . . . 0.0 113.228 -169.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.4 -36.56 69.06 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.797 1.239 . . . . 0.0 111.646 -179.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -53.06 62.63 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.093 0.957 . . . . 0.0 109.069 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -66.36 -32.42 73.8 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.398 1.079 . . . . 0.0 110.66 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -65.26 -44.43 88.12 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.889 170.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.94 -41.56 95.41 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.079 1.309 . . . . 0.0 110.878 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.447 HG22 ' CE1' ' A' ' 13' ' ' PHE . 27.9 m -68.96 -44.01 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 O-C-N 121.251 -0.906 . . . . 0.0 112.147 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 43.9 tpp -59.35 -39.56 83.63 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.03 -38.33 88.29 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.529 -0.732 . . . . 0.0 111.894 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.16 -13.8 41.38 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.52 1.528 . . . . 0.0 113.221 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 33.6 m -123.33 -5.34 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.361 1.064 . . . . 0.0 111.939 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -18.15 12.08 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -66.1 -16.9 64.34 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 120.277 1.399 . . . . 0.0 112.437 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -113.63 -36.88 4.76 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.483 0.713 . . . . 0.0 110.87 162.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -68.1 -13.07 61.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 118.003 -0.999 . . . . 0.0 112.473 -175.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -57.13 -27.41 61.82 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.486 1.494 . . . . 0.0 112.029 168.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -79.42 -5.87 55.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.285 0.634 . . . . 0.0 111.998 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.02 36.96 1.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.641 1.176 . . . . 0.0 111.205 -166.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.8 p -117.47 66.04 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 123.628 1.68 . . . . 0.0 106.577 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -153.18 36.41 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 113.942 -1.481 . . . . 0.0 109.251 -168.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.45 -176.25 39.21 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 126.087 1.803 . . . . 0.0 109.753 -173.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.45 170.07 12.95 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.459 2.773 . . . . 0.0 110.905 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -137.36 147.57 45.61 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -143.74 144.19 31.72 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.557 1.543 . . . . 0.0 107.281 -164.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.8 mm -137.19 138.1 45.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -170.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -136.28 147.66 47.6 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.441 1.896 . . . . 0.0 107.641 169.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.37 154.74 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 O-C-N 120.975 -1.078 . . . . 0.0 109.671 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -144.85 150.22 36.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 161.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.68 146.94 26.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 169.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.67 179.81 5.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.976 2.51 . . . . 0.0 108.315 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -58.39 -36.48 73.62 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -168.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 34.0 mmtp -139.16 27.14 2.37 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.119 0.967 . . . . 0.0 112.329 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.08 -168.32 37.38 Favored Glycine 0 CA--C 1.521 0.409 0 O-C-N 121.005 -1.059 . . . . 0.0 111.692 -174.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -133.0 145.19 50.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.112 1.765 . . . . 0.0 107.516 176.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -103.09 136.52 42.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 159.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -123.58 131.38 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 178.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -111.84 136.51 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 168.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 4.2 m -131.08 141.94 44.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 119.569 1.077 . . . . 0.0 108.696 172.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.2 p -134.38 162.91 30.89 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -161.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.338 0 C-N-CA 126.28 1.832 . . . . 0.0 107.492 174.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ptm . . . . . 0 N--CA 1.495 1.805 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.81 76.93 1.24 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.155 1.382 . . . . 0.0 107.794 -161.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -66.83 153.01 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 124.523 1.129 . . . . 0.0 109.599 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -146.76 138.17 24.3 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.972 1.309 . . . . 0.0 109.413 168.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mmt85 -89.85 126.45 35.71 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.98 -1.075 . . . . 0.0 108.142 166.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.1 mm -83.01 -61.94 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 172.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -153.55 17.7 0.53 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 111.526 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 74.16 -34.63 0.28 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 128.074 2.549 . . . . 0.0 113.603 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -68.56 -38.48 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.428 1.013 . . . . 0.0 108.859 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.1 m -110.12 140.4 44.24 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.642 1.577 . . . . 0.0 107.484 168.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 m -129.1 162.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 166.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -135.39 172.74 12.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.763 -1.211 . . . . 0.0 109.683 165.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -144.8 160.55 41.08 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 168.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -118.27 149.5 41.02 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 162.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 4.8 ttt -144.64 103.41 3.93 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 -168.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.8 m -67.48 153.19 44.27 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.9 m-85 -53.12 -31.63 43.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.81 -25.51 73.06 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-O 119.066 -0.852 . . . . 0.0 113.663 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.86 -37.0 75.98 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.757 1.779 . . . . 0.0 109.739 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 11.3 mt -68.49 -44.71 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.405 1.482 . . . . 0.0 109.178 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -58.46 -38.92 78.55 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.587 1.155 . . . . 0.0 111.439 174.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.66 -40.7 97.86 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.518 0.675 . . . . 0.0 111.69 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtt-85 -68.51 -11.84 60.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.016 1.327 . . . . 0.0 111.27 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.51 3.19 78.36 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.61 1.576 . . . . 0.0 112.179 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -90.19 -178.41 5.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.788 1.235 . . . . 0.0 110.081 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -137.89 153.33 49.55 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -60.65 -31.92 71.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.467 -170.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -81.79 -46.26 14.44 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -56.83 -35.73 69.16 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.0 0.92 . . . . 0.0 112.751 -171.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.1 mm -44.39 -53.49 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.604 1.162 . . . . 0.0 109.339 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 50.1 m95 -75.01 -17.07 60.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -115.33 8.95 15.53 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.328 0.651 . . . . 0.0 112.334 -165.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -142.03 92.42 2.44 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -50.86 -46.97 60.51 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.556 1.071 . . . . 0.0 112.655 -166.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.01 -21.52 65.94 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.565 -0.71 . . . . 0.0 111.515 -176.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -98.67 -5.63 31.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.062 1.345 . . . . 0.0 111.632 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.92 -49.85 14.63 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -55.78 -32.74 63.74 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.538 1.135 . . . . 0.0 112.921 -170.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -53.15 -37.13 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.798 0.839 . . . . 0.0 111.848 174.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -59.07 6.0 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -64.24 -40.02 95.16 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.073 1.349 . . . . 0.0 110.335 -173.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -61.13 -36.92 81.03 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 117.729 -1.129 . . . . 0.0 112.434 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -72.42 -37.18 68.7 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.669 1.577 . . . . 0.0 111.549 178.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.6 m -70.47 -41.45 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 120.006 1.276 . . . . 0.0 111.152 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -42.08 87.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.934 -0.479 . . . . 0.0 110.445 170.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -58.06 -40.89 82.11 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 122.757 0.423 . . . . 0.0 111.269 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.57 -5.25 2.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.927 1.691 . . . . 0.0 112.78 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.5 t -131.94 2.76 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 126.404 1.881 . . . . 0.0 109.895 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -55.76 -37.47 68.57 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.162 -1.587 . . . . 0.0 113.985 -162.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.38 -8.76 27.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -119.06 -36.13 3.47 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.787 2.035 . . . . 0.0 109.901 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -57.17 -31.85 65.82 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.931 0.892 . . . . 0.0 110.984 170.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -57.39 -21.98 39.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.68 1.127 . . . . 0.0 112.854 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -83.97 -14.23 51.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.893 0.77 . . . . 0.0 112.381 176.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.95 -0.42 3.1 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -165.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.57 69.27 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 122.994 1.378 . . . . 0.0 110.404 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -155.73 27.73 0.38 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.062 1.345 . . . . 0.0 110.195 -173.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.44 -178.82 38.82 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.021 1.296 . . . . 0.0 110.557 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.9 169.49 18.97 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.762 2.975 . . . . 0.0 111.962 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.4 tp -129.72 148.15 51.57 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.48 1.512 . . . . 0.0 107.12 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -140.02 146.87 39.58 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -170.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -135.52 142.76 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -140.13 91.21 2.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.95 1.3 . . . . 0.0 108.196 165.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.82 154.59 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.521 0.728 . . . . 0.0 109.078 166.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.0 152.05 32.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 152.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.57 143.29 32.93 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 123.612 0.765 . . . . 0.0 109.883 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 mp -129.46 -176.03 3.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.968 2.507 . . . . 0.0 108.306 -172.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.04 -34.77 76.87 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.431 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -140.42 21.69 2.38 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.303 1.041 . . . . 0.0 112.355 -177.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.9 -170.15 40.48 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mp -134.74 142.62 46.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.863 1.265 . . . . 0.0 109.262 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -94.57 143.5 26.37 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 162.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.93 123.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.4 mp -92.42 145.64 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 104.675 -2.343 . . . . 0.0 104.675 167.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.65 131.73 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.84 159.41 39.89 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -165.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 mppt? . . . . . 0 C--O 1.234 0.244 0 C-N-CA 126.97 2.108 . . . . 0.0 108.39 174.831 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.797 0.332 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -127.4 78.09 1.79 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -151.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 mp -76.8 153.71 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.494 1.118 . . . . 0.0 109.772 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -134.69 156.14 49.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.312 2.245 . . . . 0.0 108.154 170.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -124.29 89.34 3.06 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 176.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.0 -52.83 56.55 Favored 'Isoleucine or valine' 0 C--N 1.345 0.399 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -157.14 -164.1 1.53 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.189 1.796 . . . . 0.0 107.206 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -72.49 -9.93 59.17 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -176.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -126.6 -40.63 1.91 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.042 -1.036 . . . . 0.0 112.184 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.8 m -92.86 134.53 34.99 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 165.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 m -128.88 156.55 41.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 165.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -142.13 169.66 17.18 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 121.018 -1.052 . . . . 0.0 108.558 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.417 ' CD1' HG22 ' A' ' 44' ' ' VAL . 38.1 p90 -153.52 163.62 39.65 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 172.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -115.31 143.12 45.74 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -136.85 108.24 6.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.81 1.244 . . . . 0.0 107.872 -175.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -68.1 153.94 42.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-30 -52.2 -38.7 58.66 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 122.851 0.461 . . . . 0.0 112.121 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.79 -25.52 70.58 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 119.24 -0.755 . . . . 0.0 113.385 -177.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -69.31 -38.71 78.38 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.995 1.397 . . . . 0.0 109.979 175.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.54 -43.56 71.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 125.452 1.501 . . . . 0.0 108.345 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.92 -40.84 85.75 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.03 1.332 . . . . 0.0 111.581 175.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -62.85 -42.06 99.6 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.566 0.698 . . . . 0.0 111.237 -177.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -68.46 -13.19 62.14 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.916 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.1 13.32 83.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.734 1.159 . . . . 0.0 112.953 -176.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -82.86 -173.74 4.85 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.407 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.4 t70 -141.89 147.49 37.21 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -53.72 -35.77 61.54 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.834 0.743 . . . . 0.0 111.443 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.78 -42.1 25.15 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.313 0.506 . . . . 0.0 109.863 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.407 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.92 -37.71 85.68 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.05 -1.031 . . . . 0.0 111.058 -175.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.63 -43.87 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.797 1.239 . . . . 0.0 110.254 170.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.59 -28.35 66.86 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.121 0.873 . . . . 0.0 113.057 177.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -120.92 8.79 10.51 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -155.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -132.18 98.17 4.34 Favored 'General case' 0 C--N 1.335 -0.053 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.2 ttp85 -54.27 -23.45 15.04 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.245 1.418 . . . . 0.0 114.74 -169.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 -31.16 10.69 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 118.902 0.774 . . . . 0.0 111.864 178.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -79.83 -17.47 53.2 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.068 0.849 . . . . 0.0 111.316 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 p -59.35 -53.3 59.81 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 167.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -30.94 63.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.316 1.846 . . . . 0.0 113.25 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -58.54 -34.29 70.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.53 1.132 . . . . 0.0 111.165 -178.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -52.71 64.54 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 122.501 1.143 . . . . 0.0 109.023 175.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -67.82 -33.3 74.52 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.806 0.843 . . . . 0.0 109.851 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -63.23 -29.9 71.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.578 172.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -76.52 -45.11 32.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.289 1.404 . . . . 0.0 108.843 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.417 HG22 ' CD1' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -61.94 -49.33 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 36.8 tpp -63.81 -34.8 78.72 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.54 -177.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.04 -41.03 82.4 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 119.061 0.846 . . . . 0.0 111.212 174.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -35.78 78.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.768 0.427 . . . . 0.0 111.178 175.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.99 -13.06 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.088 178.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -60.01 -30.41 69.13 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -152.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -62.25 -21.09 64.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.12 0.873 . . . . 0.0 112.268 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -96.46 -1.66 46.94 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.629 1.572 . . . . 0.0 110.924 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -135.61 -15.74 1.83 Allowed 'General case' 0 C--N 1.338 0.092 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -158.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.58 -10.22 4.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.298 1.039 . . . . 0.0 113.293 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -117.46 13.76 14.49 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.88 2.072 . . . . 0.0 111.365 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.59 -22.99 1.65 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.924 1.29 . . . . 0.0 113.074 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -70.81 -4.29 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 120.638 1.563 . . . . 0.0 113.728 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -55.23 -20.62 11.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.517 1.527 . . . . 0.0 114.021 159.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -93.32 -173.39 40.24 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.637 1.113 . . . . 0.0 112.661 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -68.55 173.18 10.23 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.584 2.856 . . . . 0.0 111.08 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.1 mt -146.22 149.96 34.91 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.636 1.175 . . . . 0.0 108.431 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -147.7 148.01 30.56 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.165 1.386 . . . . 0.0 108.012 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 2.4 mm -135.51 149.4 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -138.82 143.5 38.9 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 161.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.4 p -147.76 157.06 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 O-C-N 120.405 -1.435 . . . . 0.0 109.876 -168.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -149.78 150.98 32.83 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 167.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.66 145.27 29.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 164.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -126.23 -179.8 4.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.779 2.432 . . . . 0.0 107.858 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.08 -32.26 71.91 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -166.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.0 mmtm -140.64 23.08 2.31 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.214 1.005 . . . . 0.0 112.227 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.16 -170.24 38.62 Favored Glycine 0 C--N 1.332 0.325 0 O-C-N 120.917 -1.114 . . . . 0.0 110.895 -173.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.6 mp -131.06 148.15 52.71 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.744 1.617 . . . . 0.0 107.297 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -105.38 136.12 45.5 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 158.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -127.05 120.36 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 105.007 -2.22 . . . . 0.0 105.007 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -102.61 143.65 14.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 104.634 -2.358 . . . . 0.0 104.634 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.15 141.05 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 172.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -135.92 164.2 28.51 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.361 0.664 . . . . 0.0 109.676 -165.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.288 0 C-N-CA 125.655 1.582 . . . . 0.0 108.158 172.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptm . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -127.55 79.61 1.9 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -152.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 mm -75.06 152.07 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 124.732 1.213 . . . . 0.0 109.804 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -141.95 148.35 38.49 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.579 1.952 . . . . 0.0 108.508 167.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.37 102.53 9.01 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.2 mm -70.93 -56.03 12.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 -170.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -162.61 -171.37 2.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.792 1.637 . . . . 0.0 108.84 -177.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.28 -6.12 8.91 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -118.91 -31.06 4.88 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.937 1.295 . . . . 0.0 111.601 -169.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.0 m -129.5 140.18 51.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.465 1.106 . . . . 0.0 109.278 -170.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.69 155.53 41.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 166.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -136.85 167.79 20.8 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.411 ' CE1' HG23 ' A' ' 44' ' ' VAL . 34.1 p90 -155.49 164.13 39.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.608 0.718 . . . . 0.0 109.351 172.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -114.93 142.61 46.36 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -136.43 115.53 12.42 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -72.77 158.66 35.15 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.442 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -53.61 -42.19 67.44 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 121.784 -0.573 . . . . 0.0 111.423 171.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.84 -27.05 69.51 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.167 -0.796 . . . . 0.0 113.043 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.92 -31.48 69.28 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.446 1.623 . . . . 0.0 110.778 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.8 mt -79.0 -43.97 24.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.837 1.255 . . . . 0.0 107.796 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -58.68 -40.71 84.36 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.289 1.436 . . . . 0.0 111.861 173.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.37 -44.62 95.44 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.165 0.986 . . . . 0.0 111.47 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -69.52 -6.88 33.63 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.578 173.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 12.91 84.16 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.465 1.031 . . . . 0.0 113.07 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -82.28 -174.28 5.04 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -137.35 144.65 42.64 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -55.63 -35.49 65.97 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.249 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -76.74 -44.49 33.01 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 118.708 0.686 . . . . 0.0 109.611 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.02 -37.7 83.49 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 121.389 -0.819 . . . . 0.0 111.311 -173.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -54.2 -45.82 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.78 0.832 . . . . 0.0 109.909 171.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -68.37 -22.2 64.67 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.452 1.024 . . . . 0.0 113.14 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -121.9 3.81 9.97 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -160.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -137.75 82.22 1.91 Allowed 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -178.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -46.28 -43.36 15.65 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.191 0.996 . . . . 0.0 113.654 -166.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.23 -32.21 64.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.684 -0.635 . . . . 0.0 111.683 -177.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -77.78 -20.39 53.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.647 -0.692 . . . . 0.0 110.968 174.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -52.72 62.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 166.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -52.59 -34.1 49.25 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.681 1.592 . . . . 0.0 113.311 -168.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -55.74 -36.32 67.13 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.979 1.311 . . . . 0.0 111.51 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -57.69 11.94 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.437 1.095 . . . . 0.0 108.829 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -62.6 -35.5 79.73 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.962 1.305 . . . . 0.0 110.033 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -62.87 -39.37 94.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.114 171.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -68.35 -41.88 80.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.31 1.414 . . . . 0.0 110.232 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.411 HG23 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -68.72 -42.25 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 121.331 -0.856 . . . . 0.0 111.458 -178.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.9 mmt -54.5 -48.58 71.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.177 0.591 . . . . 0.0 109.674 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.74 -41.32 90.71 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 122.521 0.329 . . . . 0.0 111.498 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -65.53 -12.54 53.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.195 1.798 . . . . 0.0 112.488 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.64 1.16 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.266 1.026 . . . . 0.0 111.778 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.55 -20.82 65.05 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -163.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.04 -20.84 60.01 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.403 1.001 . . . . 0.0 112.13 173.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -103.72 5.96 36.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.138 1.375 . . . . 0.0 111.144 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.16 -20.95 4.74 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.806 1.243 . . . . 0.0 111.93 -173.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.51 -18.58 59.73 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.277 1.031 . . . . 0.0 113.768 -173.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -102.88 3.57 36.7 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.272 1.429 . . . . 0.0 111.761 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.71 40.91 1.3 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.123 1.769 . . . . 0.0 109.869 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.94 66.61 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -153.89 37.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 113.513 -1.676 . . . . 0.0 108.86 -168.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.9 -175.31 35.53 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 126.099 1.809 . . . . 0.0 109.906 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.44 172.27 12.63 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.5 2.8 . . . . 0.0 111.465 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 35.6 mt -135.65 154.18 51.39 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.219 1.408 . . . . 0.0 107.955 171.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.9 m95 -149.2 145.7 27.26 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 125.245 1.418 . . . . 0.0 107.519 -164.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -134.82 143.71 36.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -175.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -137.6 147.44 45.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.083 1.753 . . . . 0.0 106.67 165.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.1 p -150.39 155.66 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 120.647 -1.283 . . . . 0.0 109.719 -170.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -148.95 150.63 33.2 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 164.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.19 146.16 26.12 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 167.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.32 -177.49 4.09 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.779 2.432 . . . . 0.0 108.045 177.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.51 -33.8 73.16 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.442 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -139.6 23.6 2.48 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.464 1.106 . . . . 0.0 112.607 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -179.53 -165.26 33.34 Favored Glycine 0 CA--C 1.521 0.444 0 O-C-N 121.11 -0.994 . . . . 0.0 111.624 -173.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 mp -132.48 148.55 52.4 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.939 1.696 . . . . 0.0 108.041 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -103.33 138.62 39.84 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 156.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -127.2 129.14 70.89 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.026 0 N-CA-C 104.92 -2.252 . . . . 0.0 104.92 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -112.17 141.98 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 170.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.0 m -135.9 138.39 47.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 121.243 -0.911 . . . . 0.0 108.549 171.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -133.75 166.87 21.63 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.169 0.588 . . . . 0.0 110.726 -160.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt . . . . . 0 C--O 1.234 0.274 0 C-N-CA 126.164 1.786 . . . . 0.0 110.241 167.625 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -146.03 136.95 24.46 Favored 'General case' 0 C--O 1.224 -0.274 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 -164.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.05 150.73 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 120.589 1.54 . . . . 0.0 107.95 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.88 151.91 41.56 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.699 1.2 . . . . 0.0 111.013 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 tpp85 -117.68 87.15 2.65 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.651 1.98 . . . . 0.0 106.105 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -57.1 -53.38 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.78 0.8 . . . . 0.0 109.166 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -152.85 -165.93 2.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.009 2.124 . . . . 0.0 106.32 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -78.25 0.41 25.35 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -128.97 -47.74 1.23 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.042 0.937 . . . . 0.0 111.931 -172.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 60.5 m -81.99 135.55 35.35 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 170.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.05 157.69 41.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 165.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -136.31 167.54 21.12 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 168.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.436 ' CE1' HG23 ' A' ' 44' ' ' VAL . 48.7 p90 -149.2 165.35 32.13 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 175.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -127.53 128.74 46.17 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 3.7 ttt -123.78 117.0 23.91 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.928 1.291 . . . . 0.0 108.28 -170.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.6 m -78.09 153.54 32.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.43 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.4 m-85 -58.36 -36.45 73.49 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.329 -0.857 . . . . 0.0 112.171 176.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.94 -29.8 75.76 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-O 119.456 -0.636 . . . . 0.0 112.238 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.47 -37.28 74.25 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.86 1.33 . . . . 0.0 110.474 177.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 33.0 mt -67.1 -48.84 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.803 1.241 . . . . 0.0 109.266 178.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -58.65 -38.98 79.29 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 125.467 1.507 . . . . 0.0 110.954 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.99 -41.12 91.51 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.989 0.899 . . . . 0.0 110.629 -175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.1 mtt85 -67.76 -9.19 41.85 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.174 1.39 . . . . 0.0 111.865 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.3 11.13 82.66 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.692 1.139 . . . . 0.0 113.014 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -86.38 -174.64 5.13 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 166.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -141.33 153.64 45.24 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.112 -0.992 . . . . 0.0 108.344 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -64.73 -28.5 69.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -167.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -87.19 -44.68 11.3 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -57.32 -35.77 70.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 112.95 -171.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.23 -55.8 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.895 1.278 . . . . 0.0 109.344 168.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -76.63 -14.16 60.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -119.87 6.52 10.9 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.899 0.88 . . . . 0.0 112.517 -167.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -129.0 86.22 2.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 170.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -52.27 -35.1 49.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -163.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -31.83 40.58 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.09 0.556 . . . . 0.0 111.672 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -79.94 -16.32 55.51 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.175 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.16 -50.58 72.6 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 167.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -54.62 -31.99 58.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -168.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.19 -36.23 74.98 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.016 1.326 . . . . 0.0 111.228 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -57.84 10.94 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.32 1.048 . . . . 0.0 108.701 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -63.03 -34.19 77.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.153 0.981 . . . . 0.0 110.454 -173.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -62.88 -35.89 81.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.503 -0.76 . . . . 0.0 112.516 173.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.98 -43.71 70.91 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 120.091 1.314 . . . . 0.0 110.522 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.436 HG23 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.98 -37.99 70.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 O-C-N 121.163 -0.96 . . . . 0.0 111.526 -178.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 19.5 tpp -62.74 -39.72 94.99 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.064 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -57.84 -38.61 75.96 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 120.171 1.35 . . . . 0.0 111.561 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.92 -9.96 2.18 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.658 1.583 . . . . 0.0 113.541 173.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.2 t -129.27 -9.25 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 126.3 1.84 . . . . 0.0 110.54 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.03 -28.25 69.96 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.843 -1.161 . . . . 0.0 113.984 -157.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -60.7 -16.09 35.77 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.745 0.702 . . . . 0.0 112.396 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -114.14 6.79 16.44 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.167 1.787 . . . . 0.0 110.803 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -132.73 -18.33 2.43 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.886 1.274 . . . . 0.0 112.557 -172.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.9 -23.17 60.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.567 1.076 . . . . 0.0 112.993 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -98.75 5.6 47.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.8 1.64 . . . . 0.0 111.82 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.17 -15.72 2.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.067 1.347 . . . . 0.0 112.927 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.75 3.04 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 120.282 1.401 . . . . 0.0 113.697 173.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -57.16 -19.7 21.96 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.241 1.017 . . . . 0.0 113.077 155.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -107.97 -177.84 22.18 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.233 1.397 . . . . 0.0 111.762 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.02 170.16 19.6 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.614 2.876 . . . . 0.0 112.803 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.6 tp -144.32 153.76 42.33 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.121 1.768 . . . . 0.0 106.499 169.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -142.0 151.6 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.679 1.592 . . . . 0.0 107.05 -173.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mm -139.27 139.22 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -170.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.22 167.53 22.2 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.793 1.237 . . . . 0.0 109.439 161.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.1 p -144.23 160.16 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.503 0.721 . . . . 0.0 109.864 -169.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -131.31 146.23 52.21 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 127.088 2.155 . . . . 0.0 105.574 163.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.66 129.92 55.34 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 167.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.9 mp -118.7 -169.97 1.82 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 127.083 2.153 . . . . 0.0 108.272 -169.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.24 -43.2 96.28 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.43 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.9 mmtp -142.09 25.3 1.93 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.705 1.202 . . . . 0.0 112.367 -177.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -174.49 -170.52 37.78 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mp -135.53 143.54 45.8 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.889 1.276 . . . . 0.0 108.454 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -93.14 141.23 28.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 161.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -127.88 128.4 69.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -117.13 134.59 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 103.955 -2.609 . . . . 0.0 103.955 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 9.6 m -132.55 134.96 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.2 p -132.34 174.75 9.91 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.682 0.793 . . . . 0.0 110.573 -155.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.3 mttt . . . . . 0 C--N 1.341 0.237 0 C-N-CA 124.714 1.205 . . . . 0.0 111.566 171.89 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ptm . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -130.02 130.22 44.68 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.457 1.503 . . . . 0.0 106.988 -169.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -122.63 153.1 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.967 1.258 . . . . 0.0 108.93 -171.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -142.18 151.73 42.48 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.931 1.292 . . . . 0.0 110.797 173.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -113.88 90.21 3.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.22 1.808 . . . . 0.0 106.504 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.5 mm -58.84 -53.03 53.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.981 0.896 . . . . 0.0 109.03 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -152.58 -166.97 2.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.488 2.315 . . . . 0.0 105.54 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -77.44 1.34 19.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.814 -1.179 . . . . 0.0 113.868 -173.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -129.94 -50.5 1.13 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.436 1.094 . . . . 0.0 111.116 -168.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 76.8 m -82.25 137.55 34.84 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.7 m -128.57 157.72 41.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.855 -1.906 . . . . 0.0 105.855 165.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -133.28 166.98 21.23 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 166.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.0 162.95 39.37 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -124.9 139.62 53.67 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.1 ttt -138.89 103.27 4.76 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -167.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.2 m -64.22 149.79 47.21 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.416 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.8 m-85 -55.13 -32.65 62.22 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -81.36 -11.66 83.05 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.573 -1.126 . . . . 0.0 113.426 -178.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.27 -42.96 82.98 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 120.169 1.984 . . . . 0.0 108.916 167.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -64.08 -45.4 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.13 1.372 . . . . 0.0 108.998 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 122.508 0.323 . . . . 0.0 111.531 -176.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.33 -40.64 97.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.718 0.771 . . . . 0.0 111.251 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtt-85 -65.9 -14.59 61.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 114.86 -1.063 . . . . 0.0 110.925 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.63 9.67 80.87 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 124.959 1.266 . . . . 0.0 112.762 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -83.61 -178.38 7.01 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 171.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -134.24 147.61 50.71 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -58.41 -31.1 67.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.431 -176.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -83.38 -47.14 11.76 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 173.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.05 -35.95 69.95 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.727 0.811 . . . . 0.0 112.522 -172.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -43.9 -55.82 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.465 1.106 . . . . 0.0 109.386 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -75.49 -16.26 60.32 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -172.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -116.92 7.7 13.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.748 0.819 . . . . 0.0 112.68 -166.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -136.51 88.9 2.41 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -48.95 -45.38 41.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -70.73 -30.79 67.41 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.617 -0.677 . . . . 0.0 111.007 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -78.42 -20.66 50.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.765 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.71 -49.3 71.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 167.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -53.49 -34.82 59.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.965 1.306 . . . . 0.0 112.68 -169.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -58.19 -33.96 69.84 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.719 1.208 . . . . 0.0 111.389 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -54.07 51.02 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -67.15 -36.59 82.17 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.029 0.932 . . . . 0.0 110.263 -173.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 m95 -57.37 -36.48 71.29 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.153 -0.927 . . . . 0.0 112.167 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -68.63 -42.48 77.98 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.464 1.484 . . . . 0.0 111.085 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.5 m -75.19 -38.33 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 120.935 -1.103 . . . . 0.0 111.477 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.8 mmt -59.98 -42.76 94.86 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.935 -0.555 . . . . 0.0 109.954 168.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.87 -41.25 82.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.045 0.839 . . . . 0.0 111.532 176.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -59.61 -9.34 2.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.373 1.869 . . . . 0.0 112.806 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -123.81 -8.33 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.25 1.82 . . . . 0.0 110.059 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -58.91 -28.08 65.86 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -163.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.38 -15.04 62.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.482 1.037 . . . . 0.0 112.462 177.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -112.3 -40.85 4.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.812 1.645 . . . . 0.0 109.236 174.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.73 -26.1 65.37 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.51 1.124 . . . . 0.0 112.118 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -57.5 -24.03 53.54 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.079 1.309 . . . . 0.0 112.569 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -78.83 -14.04 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.736 0.815 . . . . 0.0 112.09 176.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.21 8.57 2.47 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -164.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.16 69.1 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.936 1.35 . . . . 0.0 109.759 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -156.88 30.46 0.31 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.757 1.223 . . . . 0.0 110.088 -172.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 -179.88 37.84 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.373 0.987 . . . . 0.0 111.117 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.58 172.06 15.07 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.903 3.069 . . . . 0.0 112.317 -174.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 25.6 tp -135.93 154.32 51.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.404 1.482 . . . . 0.0 107.154 169.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -143.35 149.69 38.1 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.628 1.571 . . . . 0.0 107.256 -171.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mm -134.81 144.07 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.253 0.933 . . . . 0.0 109.728 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -138.57 150.54 46.43 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.638 1.975 . . . . 0.0 107.073 165.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.12 158.35 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.092 -1.005 . . . . 0.0 109.077 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.75 151.82 43.23 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 157.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.63 145.1 26.62 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 mp -124.27 -172.46 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.762 2.825 . . . . 0.0 107.714 -174.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.38 -37.84 84.87 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -167.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.7 mmtm -140.97 25.43 2.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.337 1.055 . . . . 0.0 112.569 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.76 -168.82 37.29 Favored Glycine 0 C--O 1.228 -0.255 0 O-C-N 120.98 -1.075 . . . . 0.0 110.551 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mp -135.01 145.34 47.99 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.729 1.211 . . . . 0.0 108.98 177.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -97.98 128.53 44.6 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 162.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.08 128.77 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.58 142.05 23.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 173.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.53 136.71 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 171.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.4 p -128.21 174.57 9.16 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.179 0.992 . . . . 0.0 110.113 -160.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 70.1 mttt . . . . . 0 CA--C 1.529 0.167 0 C-N-CA 124.969 1.308 . . . . 0.0 110.173 170.698 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptm . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 120.297 0.094 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -133.67 127.89 33.86 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 -170.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.1 mm -125.64 151.05 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.583 1.553 . . . . 0.0 107.957 -174.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -146.0 151.03 37.11 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.345 1.058 . . . . 0.0 110.885 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -112.4 101.98 10.14 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.333 1.853 . . . . 0.0 106.29 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.3 mm -70.17 -55.93 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -177.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -159.22 -170.5 3.01 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.141 1.376 . . . . 0.0 109.702 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.85 -15.74 5.35 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.206 1.403 . . . . 0.0 114.07 -175.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -124.72 -40.77 2.17 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.976 0.911 . . . . 0.0 111.468 -171.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -98.62 139.36 34.44 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 122.161 0.982 . . . . 0.0 109.305 -173.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -124.05 162.12 25.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 165.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.7 pttt -135.02 168.56 18.9 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.577 -0.702 . . . . 0.0 109.395 160.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.413 ' CE1' HG23 ' A' ' 44' ' ' VAL . 45.6 p90 -146.44 168.97 19.85 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -132.33 140.0 48.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -135.28 114.47 12.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -170.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -74.52 154.87 38.47 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.477 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-30 -53.98 -32.14 53.03 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 175.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -90.02 -8.05 67.39 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.257 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -47.65 69.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.973 1.886 . . . . 0.0 107.755 162.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.1 mt -56.85 -47.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.179 1.392 . . . . 0.0 108.546 176.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.96 -36.75 80.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 117.971 0.351 . . . . 0.0 111.74 -176.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -64.12 -41.17 97.34 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.58 0.705 . . . . 0.0 110.581 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.34 -4.02 23.84 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.771 1.228 . . . . 0.0 111.153 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.73 7.82 86.83 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.958 1.266 . . . . 0.0 112.634 173.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -84.18 -172.27 4.07 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 168.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -146.09 152.89 40.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -59.07 -33.27 70.6 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 120.168 1.349 . . . . 0.0 111.913 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.12 -48.14 21.77 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -63.16 -33.99 76.66 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 123.507 0.723 . . . . 0.0 112.51 -170.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.86 -56.74 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.036 0.934 . . . . 0.0 108.539 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -77.17 -33.85 56.46 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 121.849 -0.532 . . . . 0.0 111.57 -171.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -89.46 4.44 49.12 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.229 0.611 . . . . 0.0 111.866 -166.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -139.1 88.6 2.29 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -51.45 -38.94 56.21 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -30.57 59.2 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.586 -0.696 . . . . 0.0 111.189 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -80.56 -15.66 56.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.27 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -51.76 66.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 166.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -55.91 -31.13 62.59 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.546 1.538 . . . . 0.0 112.554 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.93 -38.66 76.32 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.897 1.279 . . . . 0.0 111.543 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -51.01 71.7 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.755 0.822 . . . . 0.0 109.223 176.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -65.24 -38.95 91.96 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.622 0.769 . . . . 0.0 110.41 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -60.46 -38.5 84.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 118.781 -0.628 . . . . 0.0 111.556 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -74.4 -33.98 63.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.708 1.14 . . . . 0.0 110.79 -174.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.413 HG23 ' CE1' ' A' ' 13' ' ' PHE . 17.8 m -72.67 -43.04 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 119.295 0.952 . . . . 0.0 111.635 175.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.0 mmt -55.05 -45.44 75.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.081 0.552 . . . . 0.0 109.61 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.38 -43.81 92.84 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.451 0.3 . . . . 0.0 111.697 176.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -63.95 -13.24 44.44 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.26 1.424 . . . . 0.0 112.491 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 m -120.84 3.18 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.339 1.056 . . . . 0.0 111.586 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -18.84 63.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -164.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.5 -23.47 65.93 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.351 0.978 . . . . 0.0 111.657 173.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -89.2 -8.13 54.21 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.447 1.099 . . . . 0.0 111.21 175.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -124.15 -18.8 5.77 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.418 1.087 . . . . 0.0 112.327 -162.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.68 -26.16 61.29 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.625 1.102 . . . . 0.0 112.179 177.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -83.73 -7.49 59.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.588 1.155 . . . . 0.0 112.651 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.3 7.92 2.0 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.561 1.144 . . . . 0.0 113.515 -166.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.263 7.6 p -79.04 71.1 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 123.077 1.418 . . . . 0.0 109.374 175.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -161.66 37.77 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.89 1.676 . . . . 0.0 108.972 -172.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.31 -173.56 22.69 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.919 1.247 . . . . 0.0 111.188 -173.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.44 179.58 4.96 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.518 2.812 . . . . 0.0 111.311 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.78 135.62 22.28 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -141.95 149.6 40.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.42 1.088 . . . . 0.0 109.084 -171.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.4 mm -132.59 145.91 33.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.896 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -138.71 92.29 2.61 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.412 1.485 . . . . 0.0 107.541 160.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.54 153.95 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.665 0.786 . . . . 0.0 108.884 166.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 152.13 34.07 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 152.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.38 143.36 32.78 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.672 0.789 . . . . 0.0 110.09 -175.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -130.12 -178.82 4.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.997 2.519 . . . . 0.0 107.914 -173.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.41 -35.04 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -164.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.1 mmtm -141.94 27.03 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.44 1.096 . . . . 0.0 112.353 178.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.89 -172.46 42.37 Favored Glycine 0 CA--C 1.519 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 110.801 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -136.72 139.45 41.92 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.515 1.126 . . . . 0.0 109.387 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -90.89 143.46 26.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 162.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.43 118.9 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.75 146.93 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 168.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.32 119.29 14.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 -174.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -121.02 165.16 15.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.637 0.653 . . . . 0.0 110.057 -163.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.35 0 C-N-CA 125.76 1.624 . . . . 0.0 108.655 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 ptm . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -124.26 77.56 1.57 Allowed 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -158.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 mm -69.61 152.68 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.174 1.39 . . . . 0.0 110.422 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -140.19 149.95 43.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.069 1.747 . . . . 0.0 109.674 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -109.24 107.62 17.93 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.0 mm -73.64 -55.53 12.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.1 p30 -163.34 -175.76 4.42 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.297 1.839 . . . . 0.0 107.373 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.3 -24.32 59.18 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.381 -1.45 . . . . 0.0 113.04 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -102.3 -25.75 13.55 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.944 0.897 . . . . 0.0 111.851 -169.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 75.6 m -128.04 137.07 52.04 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.247 1.022 . . . . 0.0 108.523 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 m -123.44 156.59 29.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 105.505 -2.035 . . . . 0.0 105.505 166.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 pttt -135.51 168.93 18.33 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 161.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -153.71 161.1 42.42 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -110.67 143.98 40.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 166.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -139.45 108.81 6.13 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 152.37 45.48 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.6 m-85 -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.02 0.528 . . . . 0.0 112.221 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.19 -25.44 69.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.058 -0.857 . . . . 0.0 113.402 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.82 -38.94 80.22 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.301 1.551 . . . . 0.0 109.64 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.2 mt -71.37 -42.27 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 125.016 1.326 . . . . 0.0 108.319 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.27 -39.55 90.8 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.787 1.235 . . . . 0.0 111.458 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -62.96 -42.1 99.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.624 0.726 . . . . 0.0 111.132 -177.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.8 mtt-85 -68.43 -11.52 59.82 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.221 173.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.55 12.34 84.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.613 1.102 . . . . 0.0 113.243 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -82.73 -175.07 5.6 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 167.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -137.2 152.83 50.32 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 170.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.8 ptt-85 -59.04 -27.69 65.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.797 1.239 . . . . 0.0 113.259 -175.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -91.52 -43.75 9.49 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.65 -34.16 70.9 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 124.245 1.018 . . . . 0.0 112.314 -174.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -44.17 -56.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 124.474 1.11 . . . . 0.0 109.128 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -74.62 -34.44 62.8 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.118 0.567 . . . . 0.0 112.06 -172.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -94.14 7.68 44.35 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -168.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -134.73 89.94 2.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -52.38 -37.42 56.29 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -164.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -32.43 58.92 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.775 0.43 . . . . 0.0 111.704 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -76.66 -20.05 57.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.898 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.3 -50.84 70.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 168.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -35.01 62.21 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.92 1.288 . . . . 0.0 112.781 -169.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -58.12 -34.92 70.75 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.371 1.068 . . . . 0.0 111.193 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -54.8 42.62 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.074 0.95 . . . . 0.0 108.707 174.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -64.85 -38.1 89.85 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.115 0.966 . . . . 0.0 110.181 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -60.74 -37.8 83.0 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.344 -0.836 . . . . 0.0 112.584 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.54 -38.39 80.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 120.363 1.438 . . . . 0.0 111.513 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.9 m -74.04 -42.01 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 121.008 -1.057 . . . . 0.0 111.677 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.04 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.856 0.462 . . . . 0.0 109.959 168.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.19 -38.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 118.06 0.391 . . . . 0.0 111.788 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.16 -13.14 15.69 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.653 1.181 . . . . 0.0 112.993 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.96 16.05 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 124.98 1.312 . . . . 0.0 111.691 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -23.99 67.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.409 -0.807 . . . . 0.0 112.328 -169.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.53 -25.82 67.54 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -91.45 -44.92 8.83 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.54 0.736 . . . . 0.0 109.261 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -64.97 -26.78 68.44 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 118.314 -0.851 . . . . 0.0 112.187 -172.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -61.31 -9.85 5.96 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 120.338 1.426 . . . . 0.0 112.785 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.68 -0.77 11.74 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.578 1.551 . . . . 0.0 111.9 173.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.97 3.87 1.25 Allowed 'General case' 0 C--N 1.342 0.254 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -166.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.267 7.9 p -81.32 57.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 120.254 1.388 . . . . 0.0 109.664 173.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -83.6 12.59 5.54 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.47 1.108 . . . . 0.0 112.361 -166.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.95 177.34 42.79 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.65 1.119 . . . . 0.0 110.635 -177.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.42 167.53 26.08 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.001 3.134 . . . . 0.0 111.017 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.91 147.98 49.56 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.42 0.629 . . . . 0.0 109.433 171.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -147.79 142.43 26.59 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 128.286 2.634 . . . . 0.0 104.296 173.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -144.15 152.55 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 120.309 1.413 . . . . 0.0 110.742 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -137.83 148.93 45.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.384 1.874 . . . . 0.0 106.697 170.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 p -141.42 160.2 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 O-C-N 120.46 -1.4 . . . . 0.0 109.459 -176.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -142.72 152.19 42.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 158.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.46 141.68 34.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -124.58 -174.84 3.12 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.927 2.491 . . . . 0.0 107.831 -172.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.29 -37.93 82.05 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -166.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 75.1 mmtt -140.45 25.67 2.2 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.339 1.056 . . . . 0.0 111.673 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.53 -170.4 39.08 Favored Glycine 0 C--O 1.227 -0.321 0 O-C-N 121.101 -1.0 . . . . 0.0 110.972 -174.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.16 146.27 44.75 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.803 1.241 . . . . 0.0 108.848 177.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -97.47 129.42 44.66 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 161.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -117.57 128.46 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 105.183 -2.154 . . . . 0.0 105.183 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -103.56 145.16 13.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 169.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.03 134.87 42.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.5 p -134.02 175.9 9.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.677 0.791 . . . . 0.0 109.82 -164.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.8 mppt? . . . . . 0 CA--C 1.533 0.318 0 C-N-CA 125.517 1.527 . . . . 0.0 108.644 171.985 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -139.78 78.72 1.68 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -145.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 mm -67.6 153.69 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 124.142 0.977 . . . . 0.0 109.404 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.92 152.65 42.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.731 1.613 . . . . 0.0 110.303 172.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.5 tpp85 -114.69 90.95 3.46 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.912 1.685 . . . . 0.0 106.758 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.42 -53.23 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 122.023 0.916 . . . . 0.0 109.019 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -151.45 -168.76 3.18 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.597 2.359 . . . . 0.0 105.558 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -77.84 5.18 10.1 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.084 -1.01 . . . . 0.0 113.69 -172.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -130.68 -55.14 1.07 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.289 1.036 . . . . 0.0 110.682 -171.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -77.38 138.6 39.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 171.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -125.36 160.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 166.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.2 pttt -134.29 168.95 17.95 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 160.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.0 142.42 25.23 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 170.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -94.05 137.94 32.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 165.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.4 ttt -131.24 116.71 18.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -174.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -76.27 154.06 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -56.66 -39.06 73.08 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.524 -0.735 . . . . 0.0 112.209 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.54 -24.61 73.88 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.763 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -28.63 64.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.083 1.442 . . . . 0.0 110.627 174.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.54 -43.45 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.825 1.25 . . . . 0.0 107.661 178.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.17 -39.58 82.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.565 1.146 . . . . 0.0 111.327 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.13 -45.25 92.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.247 1.019 . . . . 0.0 111.276 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.7 mtt85 -69.03 -6.89 30.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.341 1.056 . . . . 0.0 111.527 172.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.65 12.91 84.03 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.547 1.07 . . . . 0.0 113.194 176.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.69 -174.06 4.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 167.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -139.05 149.69 44.9 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.1 ptt180 -62.38 -31.4 72.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -168.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.54 -44.1 12.95 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 173.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.62 -35.92 68.85 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.309 1.044 . . . . 0.0 112.69 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.1 mm -43.51 -50.98 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 124.791 1.236 . . . . 0.0 110.683 169.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.4 m95 -80.22 -12.95 59.58 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.259 1.024 . . . . 0.0 113.55 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -123.03 7.28 9.24 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -166.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -124.98 99.41 6.12 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 172.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 46.2 ptt85 -60.27 -14.29 17.26 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -163.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -30.37 7.32 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.563 1.545 . . . . 0.0 111.891 178.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -79.53 -14.96 58.51 Favored 'General case' 0 C--N 1.339 0.151 0 O-C-N 121.3 -0.875 . . . . 0.0 111.322 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.5 p -52.19 -57.5 9.45 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.171 0.989 . . . . 0.0 109.533 163.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.48 -32.06 64.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.232 1.813 . . . . 0.0 112.522 -167.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -60.01 -34.8 73.84 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.661 1.185 . . . . 0.0 111.219 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -51.94 67.76 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 174.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -66.18 -38.43 88.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.429 0.691 . . . . 0.0 109.924 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -58.34 -37.55 75.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.627 -0.702 . . . . 0.0 112.097 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -64.39 -39.68 94.32 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.022 1.283 . . . . 0.0 111.134 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.8 m -82.47 -39.39 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 O-C-N 121.086 -1.009 . . . . 0.0 112.33 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 mmt -53.14 -47.07 69.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.408 0.683 . . . . 0.0 109.422 166.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.84 -42.0 78.89 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.575 0.625 . . . . 0.0 111.84 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -59.73 -14.86 16.15 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.082 1.353 . . . . 0.0 113.08 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 m -129.76 2.75 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 C-N-CA 124.396 1.078 . . . . 0.0 111.976 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -24.32 67.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -162.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.82 -15.94 35.54 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.66 0.664 . . . . 0.0 112.115 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -113.38 3.14 15.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.868 1.667 . . . . 0.0 110.957 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -115.18 -21.34 10.0 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.228 1.411 . . . . 0.0 111.346 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.31 -15.84 18.38 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -176.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -112.67 6.48 18.26 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.003 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -136.37 0.92 2.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.157 1.383 . . . . 0.0 113.217 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -78.29 73.17 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 122.947 1.356 . . . . 0.0 109.415 172.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -153.64 32.42 0.45 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.012 1.325 . . . . 0.0 109.555 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.13 -178.16 35.78 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.084 1.326 . . . . 0.0 110.84 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -71.91 171.15 17.19 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.7 2.933 . . . . 0.0 112.197 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.93 152.08 46.08 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.588 1.555 . . . . 0.0 107.121 171.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -144.11 150.51 38.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.96 1.304 . . . . 0.0 107.683 -168.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mm -135.0 144.72 33.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -172.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.63 170.59 15.56 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 148.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.27 159.6 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.513 -0.742 . . . . 0.0 110.702 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -129.18 145.37 51.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.751 2.42 . . . . 0.0 105.409 167.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.42 132.0 54.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 168.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.14 -169.81 1.86 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.415 2.286 . . . . 0.0 108.496 -170.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.87 -41.84 98.34 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -169.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -140.11 22.9 2.41 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.697 1.199 . . . . 0.0 112.445 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.19 -168.44 36.38 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mp -135.62 146.77 48.23 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.462 1.505 . . . . 0.0 108.725 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -100.83 122.67 43.81 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 164.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.73 127.25 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -109.93 142.1 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.17 115.14 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -170.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -117.24 171.04 8.22 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.582 0.628 . . . . 0.0 110.435 -163.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 68.8 mttt . . . . . 0 C--O 1.233 0.226 0 C-N-CA 125.237 1.415 . . . . 0.0 109.768 170.003 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.977 0.418 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -127.49 74.97 1.56 Allowed 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 -149.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 mm -69.29 152.56 9.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.106 1.362 . . . . 0.0 110.167 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.64 152.42 45.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.437 1.895 . . . . 0.0 109.869 172.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.9 tpp85 -118.29 91.61 3.61 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.178 1.791 . . . . 0.0 106.185 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.33 -53.38 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.4 p30 -156.92 -166.88 2.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.787 2.035 . . . . 0.0 106.54 175.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.17 2.58 23.68 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.748 -1.22 . . . . 0.0 113.886 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -129.66 -29.2 2.18 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.164 1.386 . . . . 0.0 111.894 -169.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 62.9 m -111.53 133.07 54.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.526 1.53 . . . . 0.0 107.849 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.7 m -122.65 159.25 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 165.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -139.26 172.19 13.18 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 161.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 35.9 p90 -150.49 169.81 20.6 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 169.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -122.5 144.23 49.21 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 167.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -137.48 114.89 11.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 -173.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.24 158.08 35.87 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.517 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.3 m-30 -53.01 -39.07 62.87 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.549 -0.72 . . . . 0.0 111.982 172.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.31 -25.74 73.58 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.451 -0.638 . . . . 0.0 113.051 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -34.53 76.55 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.979 1.389 . . . . 0.0 110.027 173.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 32.4 mt -76.88 -43.1 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.843 1.257 . . . . 0.0 107.907 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.83 -40.77 80.84 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.075 1.35 . . . . 0.0 111.397 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.31 -43.37 98.99 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.594 0.758 . . . . 0.0 111.312 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.1 mtt85 -70.85 -7.55 46.29 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.46 174.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 13.0 84.08 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.695 1.141 . . . . 0.0 112.952 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -82.41 -175.02 5.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.402 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.3 t70 -140.1 147.43 40.24 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -54.76 -38.06 66.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.232 0.924 . . . . 0.0 111.04 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -75.6 -45.0 40.09 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.402 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.6 mm-40 -61.1 -38.22 85.54 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.319 -0.863 . . . . 0.0 111.331 -173.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -54.95 -45.49 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 123.796 0.839 . . . . 0.0 109.773 171.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -69.03 -22.68 64.03 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.488 1.04 . . . . 0.0 112.974 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -120.46 3.93 10.73 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -161.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -137.79 82.4 1.92 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -47.7 -42.3 24.63 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -166.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -31.59 63.99 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.66 -0.65 . . . . 0.0 111.417 -178.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.57 -20.41 54.09 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.96 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -52.08 64.66 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 166.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.8 -32.33 60.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.303 1.441 . . . . 0.0 113.092 -168.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.92 -37.63 69.18 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.539 1.136 . . . . 0.0 111.671 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.32 -50.08 74.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.493 0.717 . . . . 0.0 109.689 177.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -65.16 -38.41 90.47 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.531 0.732 . . . . 0.0 109.573 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -59.87 -34.88 73.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.095 171.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.8 -40.49 69.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 120.622 1.556 . . . . 0.0 110.529 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.4 m -70.88 -41.26 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.258 -0.901 . . . . 0.0 110.927 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.2 mmt -57.95 -42.67 85.43 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.113 0.565 . . . . 0.0 110.49 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.0 -41.3 97.9 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.757 0.708 . . . . 0.0 111.779 176.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -63.37 -13.19 36.69 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.636 1.574 . . . . 0.0 111.864 174.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.5 t -109.66 -5.08 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.983 1.713 . . . . 0.0 109.655 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -56.43 -31.08 63.59 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -161.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.52 -14.67 58.52 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.225 0.92 . . . . 0.0 112.94 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -114.26 -36.9 4.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.99 1.716 . . . . 0.0 109.923 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.87 -28.02 65.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.699 1.199 . . . . 0.0 111.521 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.21 -24.93 57.86 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.405 1.002 . . . . 0.0 112.609 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -83.14 -9.89 58.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.073 0.949 . . . . 0.0 111.983 177.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -135.49 8.64 3.37 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 0.0 113.149 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.6 p -84.68 61.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 123.269 1.509 . . . . 0.0 109.15 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -156.08 31.69 0.34 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.676 1.19 . . . . 0.0 109.457 -171.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -173.87 -177.35 43.01 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.996 1.76 . . . . 0.0 109.328 -172.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.23 173.29 11.61 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.466 2.778 . . . . 0.0 112.116 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.3 tp -138.23 150.06 46.36 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 170.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -142.98 149.73 38.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.547 1.139 . . . . 0.0 107.974 -170.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mm -134.31 144.76 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -171.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -142.9 151.62 41.21 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 162.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.7 p -145.22 158.63 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.455 -1.403 . . . . 0.0 109.821 -166.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -136.32 152.21 50.43 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.58 133.18 49.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 158.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -123.51 178.26 5.26 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.544 1.938 . . . . 0.0 108.099 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.13 -31.85 70.46 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -165.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.517 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.5 mmtm -140.68 21.81 2.33 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.426 1.09 . . . . 0.0 112.656 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.29 -168.27 36.83 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 120.841 -1.162 . . . . 0.0 111.637 -174.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.7 mp -133.08 138.98 46.91 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.285 1.834 . . . . 0.0 107.4 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -94.6 143.95 26.0 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 157.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.6 mt -141.62 121.66 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -107.37 142.6 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.53 129.09 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -134.23 168.5 18.75 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.923 0.783 . . . . 0.0 111.26 -163.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.0 mttm . . . . . 0 C--O 1.236 0.364 0 C-N-CA 126.047 1.739 . . . . 0.0 109.787 168.145 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptm . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 110.851 -0.055 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -132.26 127.88 36.66 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -168.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.8 mm -123.77 151.15 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 125.083 1.353 . . . . 0.0 107.976 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -148.31 130.03 15.08 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.595 0.758 . . . . 0.0 110.827 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -88.45 110.78 21.11 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mm -74.47 -58.16 5.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.239 0 N-CA-C 108.488 -0.931 . . . . 0.0 108.488 178.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -157.62 -173.98 4.65 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.605 1.562 . . . . 0.0 108.787 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -56.38 -14.81 3.23 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -174.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -121.09 -46.69 2.31 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.795 1.238 . . . . 0.0 110.879 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.1 m -94.7 142.3 27.61 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.93 0.872 . . . . 0.0 109.621 -172.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.8 m -126.13 163.72 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 166.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.2 pttt -134.04 169.13 17.59 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.496 -0.752 . . . . 0.0 109.243 160.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -147.07 167.09 24.96 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 123.831 0.853 . . . . 0.0 108.699 172.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -132.97 143.58 49.55 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 170.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.3 ttt -141.8 112.02 6.93 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -168.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.91 156.06 40.06 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 175.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.468 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -55.33 -40.5 71.26 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.389 -0.819 . . . . 0.0 111.978 176.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.86 -12.98 84.08 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 118.612 -1.105 . . . . 0.0 113.769 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.02 -33.74 76.49 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.858 1.829 . . . . 0.0 109.282 166.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.5 mt -77.81 -40.9 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.96 -37.16 81.43 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.207 0.458 . . . . 0.0 111.584 175.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -64.5 -42.43 95.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.87 0.843 . . . . 0.0 111.182 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.6 mtt85 -70.1 -8.02 46.14 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.37 -1.286 . . . . 0.0 111.386 173.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.09 12.81 84.29 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.492 1.044 . . . . 0.0 112.988 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -83.6 -171.87 3.83 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 165.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -139.61 148.17 42.11 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.5 ptt85 -57.96 -31.05 66.49 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 118.77 -0.633 . . . . 0.0 112.064 -177.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -83.1 -46.07 13.23 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.35 -36.46 68.81 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.811 0.844 . . . . 0.0 112.472 -173.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mm -46.03 -48.97 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.508 1.123 . . . . 0.0 110.342 171.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -80.45 -13.35 59.19 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.939 1.088 . . . . 0.0 113.939 -175.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -122.01 10.87 10.19 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.046 0.839 . . . . 0.0 112.731 -166.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -133.63 99.26 4.43 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -58.75 -15.61 12.91 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -164.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.4 -30.83 7.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.463 1.505 . . . . 0.0 111.708 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -78.5 -15.7 58.31 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 118.923 0.783 . . . . 0.0 111.597 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 p -53.56 -60.69 2.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.036 0.935 . . . . 0.0 109.477 164.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -58.46 -29.15 65.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.854 1.662 . . . . 0.0 112.454 -165.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.12 -38.15 73.04 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.728 1.211 . . . . 0.0 111.394 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.2 -55.59 32.96 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -63.02 -35.98 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.565 1.146 . . . . 0.0 110.635 -175.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.7 m95 -63.8 -38.4 90.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.686 -1.149 . . . . 0.0 112.018 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -68.62 -45.54 71.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.737 1.608 . . . . 0.0 109.868 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.6 -45.97 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 O-C-N 121.489 -0.757 . . . . 0.0 110.581 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.5 tpp -61.85 -37.05 83.04 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.868 -0.52 . . . . 0.0 109.946 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -64.92 -41.86 95.19 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.074 0.852 . . . . 0.0 111.511 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.96 -41.48 98.04 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.549 1.14 . . . . 0.0 110.186 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.7 t -73.5 -16.87 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.685 1.194 . . . . 0.0 111.174 176.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -58.15 -26.31 62.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.68 1.582 . . . . 0.0 115.22 -157.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -58.9 -22.71 60.01 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.608 1.095 . . . . 0.0 112.122 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -95.16 -2.14 50.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.326 1.45 . . . . 0.0 111.615 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -134.09 -16.73 2.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.361 1.065 . . . . 0.0 112.567 -161.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.82 -17.43 36.07 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.447 1.099 . . . . 0.0 113.44 -178.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -107.17 3.69 25.96 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.703 1.601 . . . . 0.0 111.684 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.54 18.75 2.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.43 1.492 . . . . 0.0 112.14 -175.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.3 p -92.07 73.26 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.856 1.312 . . . . 0.0 107.694 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -152.96 31.78 0.49 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.004 -172.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.72 -179.22 37.16 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.061 1.315 . . . . 0.0 110.467 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -71.83 170.32 19.06 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.521 2.814 . . . . 0.0 112.001 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 49.1 mt -135.45 155.53 50.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.501 1.52 . . . . 0.0 107.731 171.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -150.62 147.22 27.14 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.441 1.497 . . . . 0.0 107.201 -162.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 8.4 mm -131.81 141.27 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -136.73 88.89 2.4 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.706 1.602 . . . . 0.0 106.798 167.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.21 154.41 8.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 166.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.66 152.3 33.78 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 152.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.0 143.36 33.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 109.617 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -129.51 -175.83 3.71 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 127.947 2.499 . . . . 0.0 107.898 -171.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.0 -38.25 82.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -164.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.8 mmtm -142.3 28.15 1.69 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.557 1.143 . . . . 0.0 111.746 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.13 -172.61 41.04 Favored Glycine 0 CA--C 1.517 0.165 0 O-C-N 121.14 -0.975 . . . . 0.0 110.876 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.58 139.77 44.12 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 124.392 1.077 . . . . 0.0 109.447 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -90.79 145.74 24.54 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 161.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.0 mt -134.97 122.59 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 106.789 -1.559 . . . . 0.0 106.789 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -93.99 146.57 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 169.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.7 118.24 11.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 -171.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -124.55 173.87 8.19 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.81 0.732 . . . . 0.0 111.44 -159.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.5 mttt . . . . . 0 C--N 1.342 0.257 0 C-N-CA 125.179 1.392 . . . . 0.0 109.972 165.398 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.551 0.204 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -135.62 130.88 35.07 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 125.418 1.487 . . . . 0.0 106.998 -170.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.8 mm -122.39 152.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.51 1.524 . . . . 0.0 108.646 -173.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -143.92 149.29 36.63 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.21 1.404 . . . . 0.0 110.617 169.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -112.5 102.4 10.51 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.7 mm -70.98 -55.3 14.53 Favored 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.2 p30 -163.03 -170.39 2.31 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.99 1.716 . . . . 0.0 107.863 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.19 -20.05 63.77 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.729 -1.232 . . . . 0.0 112.509 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -108.25 -30.4 8.38 Favored 'General case' 0 CA--C 1.522 -0.103 0 O-C-N 121.136 -0.977 . . . . 0.0 111.606 -163.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.6 m -123.1 138.72 54.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.788 1.235 . . . . 0.0 108.755 -178.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -125.92 157.25 35.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 162.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -135.38 167.45 21.02 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 166.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.455 ' CE1' HG21 ' A' ' 44' ' ' VAL . 55.2 p90 -152.68 167.95 27.27 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -130.31 137.07 49.76 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 tpt -132.88 106.76 7.9 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -168.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -68.4 156.29 38.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 175.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.456 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.6 m-85 -55.66 -37.02 67.73 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.487 -0.758 . . . . 0.0 111.425 173.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.05 -32.33 83.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.371 -0.683 . . . . 0.0 112.723 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -40.17 85.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.173 1.486 . . . . 0.0 110.05 177.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 31.6 mt -67.0 -49.28 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.827 1.251 . . . . 0.0 109.116 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -59.63 -38.18 80.65 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 126.042 1.737 . . . . 0.0 111.293 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.76 -40.2 91.82 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.034 0.921 . . . . 0.0 110.521 -175.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -70.57 -7.95 47.85 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.282 -1.326 . . . . 0.0 111.611 173.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.42 10.31 84.72 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.926 1.25 . . . . 0.0 113.234 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -84.04 -178.5 6.99 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 168.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.47 151.14 45.96 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.024 -1.047 . . . . 0.0 108.562 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -62.95 -31.22 72.27 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -166.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.54 -42.37 13.58 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -60.53 -34.82 74.67 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 123.729 0.812 . . . . 0.0 112.175 -172.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.4 mm -41.75 -57.26 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.418 1.087 . . . . 0.0 109.137 167.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -73.17 -38.68 66.1 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.821 0.449 . . . . 0.0 111.664 -173.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -89.34 4.14 49.88 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -169.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -130.74 84.31 2.18 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -51.6 -41.87 61.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.394 -0.816 . . . . 0.0 112.687 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -28.48 66.71 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.49 -0.756 . . . . 0.0 111.712 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -81.61 -18.45 44.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.417 -0.802 . . . . 0.0 111.299 175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.33 -46.69 85.47 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 163.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.516 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 8.6 tt0 -53.89 -32.91 54.96 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.213 1.005 . . . . 0.0 113.415 -171.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.25 -32.71 73.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.422 1.489 . . . . 0.0 111.028 -176.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -47.34 85.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.516 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 1.4 m-30 -68.97 -43.31 75.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.295 1.038 . . . . 0.0 109.521 -173.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -54.91 -39.47 68.83 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.471 -0.776 . . . . 0.0 111.533 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.8 -39.2 90.7 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.557 1.071 . . . . 0.0 111.333 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.455 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.5 m -78.39 -39.19 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.002 -1.061 . . . . 0.0 112.02 -174.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.5 mmm -55.32 -48.11 74.63 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.3 -38.23 79.72 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.39 -16.57 9.48 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.439 1.495 . . . . 0.0 112.733 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 m -135.87 12.01 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 125.386 1.474 . . . . 0.0 111.117 -173.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -21.45 62.59 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -160.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -58.71 -28.34 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.996 0.918 . . . . 0.0 111.254 174.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -90.63 3.15 54.94 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.363 1.465 . . . . 0.0 111.327 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -134.31 -24.81 1.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 O-C-N 121.237 -0.914 . . . . 0.0 112.822 -161.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -57.28 -22.93 45.02 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.106 0.963 . . . . 0.0 113.134 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -95.53 4.52 53.11 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.115 1.366 . . . . 0.0 112.359 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.25 -24.46 2.07 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.444 1.098 . . . . 0.0 113.153 -175.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -73.43 1.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 120.142 1.337 . . . . 0.0 113.336 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -56.7 -18.53 12.69 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.123 1.369 . . . . 0.0 113.366 156.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.57 -173.44 23.04 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.433 1.492 . . . . 0.0 111.911 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.46 171.69 12.57 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.421 2.747 . . . . 0.0 111.832 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.98 152.1 48.58 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.346 1.459 . . . . 0.0 107.442 175.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -147.85 145.04 28.55 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 125.598 1.559 . . . . 0.0 107.615 -164.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -133.79 141.28 44.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -138.24 159.39 42.17 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.77 2.028 . . . . 0.0 107.27 167.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.87 162.53 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 120.553 -1.342 . . . . 0.0 110.968 -170.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.36 149.01 52.44 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 126.862 2.065 . . . . 0.0 106.041 160.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.07 129.59 55.47 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 167.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 mp -118.9 -175.3 2.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 108.319 -170.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.28 -35.52 80.61 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -166.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.456 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.5 mmtm -141.42 23.93 2.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.346 1.059 . . . . 0.0 112.124 -178.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.05 -171.4 40.58 Favored Glycine 0 N--CA 1.454 -0.138 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mp -136.77 143.08 43.04 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.432 1.093 . . . . 0.0 108.341 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -90.25 141.46 28.69 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 161.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.427 ' HB ' ' CZ ' ' A' ' 13' ' ' PHE . 0.7 OUTLIER -127.98 132.36 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 175.197 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -112.5 139.05 39.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 104.406 -2.442 . . . . 0.0 104.406 177.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.26 142.22 41.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 119.302 0.955 . . . . 0.0 109.935 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -136.86 170.86 15.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.411 0.684 . . . . 0.0 110.193 -159.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 124.862 1.265 . . . . 0.0 108.9 169.331 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.498 1.963 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -130.2 127.06 38.9 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -170.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 mm -121.55 150.43 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.876 1.27 . . . . 0.0 108.861 -170.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -146.45 150.4 35.55 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.047 1.339 . . . . 0.0 109.923 172.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.17 99.83 6.27 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -179.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -71.1 -56.09 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -168.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.0 p30 -156.27 -168.09 2.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.476 1.51 . . . . 0.0 108.376 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.4 -17.1 58.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -117.3 -53.65 2.43 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.166 -0.959 . . . . 0.0 109.671 -167.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 44.9 m -86.55 138.06 32.02 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.81 0.844 . . . . 0.0 109.48 177.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.5 m -131.65 158.98 43.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 165.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -144.32 170.38 16.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.933 -1.105 . . . . 0.0 109.975 170.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.42 ' CE1' HG22 ' A' ' 44' ' ' VAL . 53.7 p90 -151.93 167.76 27.33 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -128.92 141.08 51.39 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 173.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.4 ttt -140.8 105.67 4.95 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -167.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.1 m -65.79 149.86 49.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.421 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.2 m-85 -55.88 -32.89 64.1 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.5 -7.58 81.98 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 118.572 -1.126 . . . . 0.0 113.362 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -66.87 -49.04 66.92 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.26 2.03 . . . . 0.0 107.958 164.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.36 -46.43 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.197 1.399 . . . . 0.0 108.855 177.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.71 -36.29 80.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.328 0.251 . . . . 0.0 111.397 -176.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.39 -40.69 85.69 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.493 0.717 . . . . 0.0 111.027 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.7 mtp85 -64.07 -14.97 58.4 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.988 -1.005 . . . . 0.0 111.703 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.05 7.19 80.94 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.33 -0.705 . . . . 0.0 113.18 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -80.45 -174.88 4.87 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 166.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -138.79 148.4 43.77 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -59.08 -30.68 68.25 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.595 0.634 . . . . 0.0 112.469 -174.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -82.69 -48.78 10.5 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.33 -36.61 66.44 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.989 0.916 . . . . 0.0 112.919 -171.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -44.29 -54.76 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 124.391 1.076 . . . . 0.0 109.354 170.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -76.95 -11.96 59.88 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -121.76 7.24 9.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.695 0.798 . . . . 0.0 112.84 -167.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -136.66 87.04 2.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.473 -2.047 . . . . 0.0 105.473 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -51.12 -38.14 50.13 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -164.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.28 -32.13 58.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.614 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -79.53 -18.1 52.6 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.286 176.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -48.99 75.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 166.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -53.27 -34.74 58.49 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.292 1.437 . . . . 0.0 112.696 -169.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -59.26 -32.98 70.5 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.377 1.471 . . . . 0.0 111.315 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -57.84 11.09 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.418 1.087 . . . . 0.0 108.328 173.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -63.98 -36.73 84.94 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.848 1.259 . . . . 0.0 110.918 -172.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -56.11 -44.23 78.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.778 172.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.23 -41.54 76.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.498 1.045 . . . . 0.0 111.279 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.42 HG22 ' CE1' ' A' ' 13' ' ' PHE . 17.6 m -70.96 -43.21 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 121.217 -0.927 . . . . 0.0 111.389 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 50.5 tpp -56.8 -43.28 80.78 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 123.621 0.768 . . . . 0.0 109.056 172.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.55 -40.26 94.05 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.457 -0.777 . . . . 0.0 111.925 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.72 -9.45 9.25 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.604 1.561 . . . . 0.0 112.896 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 22.6 m -128.92 6.21 2.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 C-N-CA 124.614 1.166 . . . . 0.0 111.431 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -26.31 64.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -164.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -60.23 -22.79 63.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.986 0.914 . . . . 0.0 112.209 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -103.94 -3.23 25.0 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.167 1.387 . . . . 0.0 111.372 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -121.61 -14.8 8.11 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.222 1.009 . . . . 0.0 112.097 -169.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.64 -25.59 53.83 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.126 0.876 . . . . 0.0 112.746 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -76.24 -21.45 56.35 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.764 0.826 . . . . 0.0 112.351 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -127.21 -2.35 6.35 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 124.731 1.212 . . . . 0.0 113.646 -162.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.7 p -77.48 64.6 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 123.24 1.495 . . . . 0.0 110.329 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -159.97 35.92 0.18 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.302 1.441 . . . . 0.0 108.877 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.1 -175.93 33.64 Favored Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.819 1.676 . . . . 0.0 110.377 -173.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.28 172.22 11.5 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.53 2.82 . . . . 0.0 111.442 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.4 tp -137.79 150.62 47.36 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 173.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -143.02 147.03 34.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.075 1.35 . . . . 0.0 107.538 -170.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.9 mm -132.18 144.85 35.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -136.22 154.51 50.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.071 1.748 . . . . 0.0 106.612 162.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -140.03 160.38 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 O-C-N 121.014 -1.053 . . . . 0.0 109.801 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.76 147.25 52.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.862 2.065 . . . . 0.0 105.519 162.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.53 128.47 55.21 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 167.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.9 mp -117.76 -172.82 2.31 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.616 2.366 . . . . 0.0 108.021 -169.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.92 -38.58 88.96 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.323 -0.861 . . . . 0.0 113.303 -166.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.4 mmtm -141.34 25.4 2.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.653 1.181 . . . . 0.0 112.298 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.54 -169.44 37.93 Favored Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mp -135.78 144.2 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.457 1.103 . . . . 0.0 108.437 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -92.61 140.6 29.38 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 160.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -128.47 127.9 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 104.443 -2.428 . . . . 0.0 104.443 175.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -108.89 143.66 18.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 104.776 -2.305 . . . . 0.0 104.776 176.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 131.7 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 -172.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -135.31 167.96 20.07 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.619 0.645 . . . . 0.0 110.206 -167.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? . . . . . 0 N--CA 1.468 0.447 0 C-N-CA 126.492 1.917 . . . . 0.0 107.726 175.54 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 111.412 0.153 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.28 130.49 44.6 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 125.33 1.452 . . . . 0.0 107.154 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 mm -123.63 151.22 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 120.175 1.352 . . . . 0.0 108.889 -170.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -143.37 151.2 40.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.703 1.601 . . . . 0.0 109.484 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.12 93.5 3.83 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm -66.2 -54.46 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -170.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -155.72 -160.81 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.538 1.535 . . . . 0.0 108.706 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -72.13 -10.96 60.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -175.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -130.74 -40.81 1.2 Allowed 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.273 -0.892 . . . . 0.0 111.686 -166.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.7 m -91.65 132.51 36.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.5 m -135.99 155.94 36.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 164.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.2 pttt -140.4 168.78 18.99 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.29 -0.882 . . . . 0.0 109.82 176.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -149.56 164.67 34.45 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 175.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -125.69 141.21 52.13 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 173.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.7 ttt -139.65 104.95 5.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -167.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -67.04 148.96 51.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-85 -51.83 -42.12 62.31 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.51 -11.88 80.21 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.412 -1.216 . . . . 0.0 113.842 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.9 -41.33 95.69 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.905 1.852 . . . . 0.0 109.214 166.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.3 mt -71.65 -40.98 71.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.179 1.391 . . . . 0.0 108.177 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.52 -35.67 80.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.156 0.435 . . . . 0.0 111.655 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -65.08 -40.46 94.65 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.91 0.862 . . . . 0.0 111.188 -175.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 56.8 mtt-85 -67.02 -15.18 63.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.847 1.259 . . . . 0.0 110.783 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.09 11.18 82.82 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.893 1.235 . . . . 0.0 113.055 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -83.7 -175.31 5.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 170.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -139.04 153.96 48.16 Favored 'General case' 0 CA--C 1.519 -0.231 0 O-C-N 121.247 -0.908 . . . . 0.0 108.566 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.9 ptt-85 -60.74 -29.29 69.3 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.755 1.222 . . . . 0.0 113.611 -172.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -90.6 -42.85 10.55 Favored 'General case' 0 C--O 1.226 -0.17 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -59.04 -34.41 71.89 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.193 0.997 . . . . 0.0 112.776 -174.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -42.25 -58.29 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.532 1.133 . . . . 0.0 109.364 167.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -73.04 -33.3 65.63 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.456 0.702 . . . . 0.0 112.235 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -96.2 4.84 52.13 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -168.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -128.38 88.51 2.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -50.06 -42.9 50.77 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -167.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -30.35 64.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.554 -0.716 . . . . 0.0 111.121 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -79.95 -17.55 52.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.214 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -48.8 76.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 167.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.55 -34.95 62.69 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.216 1.406 . . . . 0.0 112.408 -169.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.06 -34.73 68.55 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.897 1.279 . . . . 0.0 111.525 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -54.71 43.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.492 1.117 . . . . 0.0 108.245 175.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -66.28 -37.7 86.08 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.482 1.113 . . . . 0.0 110.665 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -57.75 -36.75 72.53 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 117.913 -1.041 . . . . 0.0 112.098 172.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -68.56 -42.92 77.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.524 1.511 . . . . 0.0 110.629 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 m -73.01 -41.31 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 121.167 -0.958 . . . . 0.0 111.075 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.2 mmt -59.2 -41.86 89.52 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.38 0.672 . . . . 0.0 110.38 170.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.89 -42.95 98.99 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.576 0.625 . . . . 0.0 111.229 176.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -8.3 15.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.554 1.541 . . . . 0.0 112.031 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.53 -3.82 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.441 1.896 . . . . 0.0 109.566 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -56.71 -28.29 60.69 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -163.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.15 -15.09 59.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.474 1.034 . . . . 0.0 113.047 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -118.68 -31.45 4.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.592 1.157 . . . . 0.0 111.162 169.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.44 -26.65 61.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.078 -1.014 . . . . 0.0 111.316 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.87 -15.56 8.94 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.817 1.19 . . . . 0.0 113.703 175.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -122.59 13.91 10.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.542 1.137 . . . . 0.0 111.721 174.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.34 -1.7 8.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.79 1.236 . . . . 0.0 112.385 171.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.0 p -75.97 68.22 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 124.848 1.259 . . . . 0.0 110.091 167.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -152.96 27.63 0.53 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.162 0.985 . . . . 0.0 110.554 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.73 178.73 46.41 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.975 1.274 . . . . 0.0 110.579 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.45 174.15 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 124.113 3.209 . . . . 0.0 111.818 -178.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -128.37 152.58 48.01 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.873 1.269 . . . . 0.0 107.776 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -140.17 151.22 45.07 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.304 1.842 . . . . 0.0 106.939 -172.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -134.27 144.12 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.949 0.795 . . . . 0.0 109.046 -172.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -137.49 155.6 49.1 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.609 1.963 . . . . 0.0 107.066 164.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.9 p -147.92 156.48 9.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 120.435 -1.415 . . . . 0.0 110.036 -172.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.03 145.77 51.65 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 164.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.49 132.43 51.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.15 -177.56 3.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.931 2.493 . . . . 0.0 107.97 -170.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.87 -36.52 79.42 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -164.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 45.8 mmtm -141.63 27.79 1.84 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.405 1.082 . . . . 0.0 112.01 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.66 -171.99 40.08 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -174.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.86 144.51 41.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.897 1.279 . . . . 0.0 108.384 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -94.52 137.35 33.75 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 161.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -126.52 125.43 67.24 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 N-CA-C 104.993 -2.225 . . . . 0.0 104.993 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.5 142.71 18.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.47 147.13 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 118.475 0.579 . . . . 0.0 109.761 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.26 170.19 16.46 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.173 0.989 . . . . 0.0 110.01 -164.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 mttt . . . . . 0 C--N 1.344 0.329 0 C-N-CA 124.099 0.96 . . . . 0.0 111.225 171.227 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -124.55 75.71 1.43 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -155.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 mm -65.92 153.04 8.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 125.053 1.341 . . . . 0.0 110.106 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -141.11 151.41 43.92 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.02 1.728 . . . . 0.0 110.118 170.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -114.69 89.85 3.2 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.067 1.747 . . . . 0.0 106.502 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -59.49 -53.28 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 34.6 p-10 -154.13 -166.16 2.29 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.778 2.031 . . . . 0.0 106.413 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.33 0.34 25.88 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 120.937 -1.102 . . . . 0.0 113.337 -174.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -126.59 -53.82 1.45 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 124.337 1.055 . . . . 0.0 110.051 -169.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.1 m -80.48 135.88 36.21 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 169.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.3 m -128.9 156.75 41.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 163.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.5 pttt -136.13 170.98 15.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 168.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.32 150.95 32.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -101.29 145.81 28.37 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 164.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.2 ttt -141.29 105.45 4.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 124.488 1.115 . . . . 0.0 108.195 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -66.4 150.72 48.48 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.469 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.9 m-85 -53.01 -42.63 65.81 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.11 -9.39 84.0 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 119.804 -1.189 . . . . 0.0 113.488 -175.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -66.46 -45.14 80.73 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.796 1.798 . . . . 0.0 108.854 165.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 23.0 mt -65.34 -42.15 93.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 C-N-CA 124.959 1.304 . . . . 0.0 107.706 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -62.73 -38.84 92.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.412 0.551 . . . . 0.0 111.627 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.37 -42.56 83.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.376 0.67 . . . . 0.0 110.574 -177.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.4 mtt85 -67.09 -7.96 26.99 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.14 0.976 . . . . 0.0 112.019 170.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.66 8.37 86.12 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.075 0.845 . . . . 0.0 113.058 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -85.7 -171.11 3.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 168.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -143.2 153.96 43.37 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -62.29 -33.34 74.45 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -167.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.13 -43.27 13.19 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -57.46 -35.26 69.92 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.088 0.955 . . . . 0.0 112.749 -172.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -42.61 -56.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.33 1.052 . . . . 0.0 109.475 168.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -77.04 -14.87 59.77 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.274 1.03 . . . . 0.0 113.681 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -118.66 7.09 11.63 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.874 0.87 . . . . 0.0 112.429 -167.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -130.09 86.65 2.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -50.23 -40.07 46.41 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -165.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -30.73 59.92 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.719 -0.613 . . . . 0.0 111.324 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -79.78 -16.73 54.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.296 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.94 -48.19 79.99 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 168.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -54.8 -33.73 61.85 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.212 1.405 . . . . 0.0 112.457 -170.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.36 -35.34 71.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.679 1.192 . . . . 0.0 111.277 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -55.84 29.19 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -63.9 -36.48 84.08 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.468 1.107 . . . . 0.0 110.518 -175.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 72.1 m95 -61.21 -40.02 92.41 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.272 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -69.37 -38.13 77.91 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.666 1.575 . . . . 0.0 111.099 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.6 m -74.15 -40.54 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 121.03 -1.044 . . . . 0.0 111.737 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.1 tpp -60.79 -39.51 89.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.02 172.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.63 -38.93 75.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.698 1.135 . . . . 0.0 111.638 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.3 -8.07 5.29 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.421 1.488 . . . . 0.0 113.478 174.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.0 t -129.58 -10.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 125.596 1.558 . . . . 0.0 110.879 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.98 -29.83 68.71 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -158.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.92 -16.72 45.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.766 0.712 . . . . 0.0 112.571 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -113.43 8.48 17.89 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.188 1.795 . . . . 0.0 110.893 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -131.4 -17.14 2.99 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 125.138 1.375 . . . . 0.0 111.896 -173.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.68 -16.87 18.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -108.73 5.93 25.2 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.953 1.701 . . . . 0.0 112.006 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.54 -3.89 2.96 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.515 1.526 . . . . 0.0 112.776 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.73 67.24 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 123.156 1.455 . . . . 0.0 110.125 169.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -161.33 39.09 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.612 1.565 . . . . 0.0 108.141 -171.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.68 -174.63 27.63 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 125.727 1.632 . . . . 0.0 110.245 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.27 174.34 9.23 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.7 2.933 . . . . 0.0 111.509 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.4 tp -145.66 147.76 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.868 1.267 . . . . 0.0 108.064 173.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -144.13 147.15 33.33 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.022 1.329 . . . . 0.0 107.807 -175.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.7 mm -139.56 140.86 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -173.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -144.26 169.52 17.73 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.621 1.168 . . . . 0.0 109.583 161.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.2 p -146.65 162.45 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.173 -0.955 . . . . 0.0 109.955 -169.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -133.86 148.07 51.24 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 126.685 1.994 . . . . 0.0 105.631 161.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.38 129.2 55.54 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 166.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -119.47 -177.55 3.4 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.557 2.343 . . . . 0.0 108.1 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.66 -35.95 79.43 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -165.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.469 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.2 mmtm -140.96 26.3 2.06 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.478 1.111 . . . . 0.0 112.073 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.26 -171.42 39.25 Favored Glycine 0 C--O 1.228 -0.22 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 -174.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -137.59 144.96 42.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 125.186 1.394 . . . . 0.0 108.111 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -96.43 140.39 31.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 161.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -126.76 128.08 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.57 134.45 60.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 104.078 -2.564 . . . . 0.0 104.078 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.1 m -131.68 135.04 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -127.56 159.46 34.55 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -161.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? . . . . . 0 C--O 1.235 0.329 0 C-N-CA 125.025 1.33 . . . . 0.0 108.047 172.622 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.398 0.142 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -138.12 117.52 12.85 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -162.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 mp -112.76 152.92 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 120.649 1.568 . . . . 0.0 108.223 -177.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -137.17 150.58 48.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.387 1.875 . . . . 0.0 109.239 172.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.25 106.3 15.67 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 173.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 38.4 mm -70.69 -54.77 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -179.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -159.11 -168.19 2.28 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.631 1.572 . . . . 0.0 108.665 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -60.29 -15.77 28.24 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.799 1.24 . . . . 0.0 113.475 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -125.57 -46.64 1.73 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.174 -0.953 . . . . 0.0 111.785 -168.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.3 m -87.45 141.5 28.58 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -128.66 157.57 41.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 164.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -133.81 166.57 22.36 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 164.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.446 ' CE1' HG21 ' A' ' 44' ' ' VAL . 46.7 p90 -151.96 170.8 18.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -132.77 136.39 46.3 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -129.76 114.36 15.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 -171.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.97 154.63 39.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.468 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.1 m-85 -55.48 -39.02 69.89 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.389 -0.819 . . . . 0.0 111.58 173.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.34 -25.7 72.52 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-O 119.119 -0.823 . . . . 0.0 113.126 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -37.23 81.69 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.402 1.601 . . . . 0.0 109.736 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 71.1 mt -73.74 -43.18 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.07 -39.95 87.82 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.809 1.244 . . . . 0.0 111.7 176.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.89 -42.36 99.75 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.698 0.799 . . . . 0.0 111.145 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.3 mtt85 -68.19 -12.17 60.5 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.37 173.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 12.57 84.05 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.799 1.19 . . . . 0.0 112.829 -177.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -82.02 -177.72 6.72 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 168.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -132.19 146.89 52.33 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -57.11 -30.37 64.32 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.366 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -82.85 -50.05 9.04 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.933 0.788 . . . . 0.0 109.169 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -55.9 -36.0 67.17 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.228 1.011 . . . . 0.0 112.671 -171.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.72 -56.55 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.587 1.155 . . . . 0.0 109.524 169.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -76.04 -13.78 60.22 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -118.38 7.75 12.02 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.585 0.754 . . . . 0.0 112.32 -167.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -137.62 88.25 2.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.04 -2.207 . . . . 0.0 105.04 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -49.85 -42.86 48.38 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -165.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 -32.25 65.59 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 121.594 -0.691 . . . . 0.0 111.016 -178.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -77.56 -18.84 56.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.072 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -55.44 24.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 165.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -52.14 -33.96 42.42 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.498 1.519 . . . . 0.0 113.171 -166.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -54.52 -40.59 68.75 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.47 1.108 . . . . 0.0 111.264 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -51.29 70.22 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.173 0.989 . . . . 0.0 109.576 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -65.55 -34.61 78.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.019 0.927 . . . . 0.0 110.131 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -62.08 -36.58 82.1 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.613 -1.184 . . . . 0.0 112.446 172.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.36 -46.63 82.58 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 121.082 1.765 . . . . 0.0 110.856 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.446 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.51 -41.49 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 121.78 -0.575 . . . . 0.0 110.762 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 tpp -59.68 -41.86 91.64 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.451 0.7 . . . . 0.0 109.715 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -62.02 -42.16 98.87 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.411 -0.805 . . . . 0.0 111.37 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -64.6 -8.43 14.19 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 126.328 1.851 . . . . 0.0 112.211 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.9 m -125.92 4.08 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.761 1.224 . . . . 0.0 111.907 175.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.47 -25.48 66.06 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -163.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -61.46 -23.25 65.73 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.451 1.023 . . . . 0.0 111.78 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -90.89 -7.59 51.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.584 1.154 . . . . 0.0 111.492 177.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.57 -23.59 2.32 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -157.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.34 -27.27 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.52 1.055 . . . . 0.0 112.539 -176.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -79.45 -10.51 59.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.164 0.985 . . . . 0.0 112.376 176.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -131.97 -10.67 3.4 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.461 1.105 . . . . 0.0 113.82 -163.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.8 m -72.59 3.56 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.73 1.605 . . . . 0.0 113.714 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -58.01 -21.21 43.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.426 1.09 . . . . 0.0 113.302 156.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.76 -175.89 38.31 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.889 1.233 . . . . 0.0 112.191 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -72.53 171.24 17.53 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 112.154 -175.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 28.6 tp -142.26 152.11 42.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.506 1.522 . . . . 0.0 106.936 166.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -142.65 152.06 42.07 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.884 1.674 . . . . 0.0 107.087 -173.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mm -135.18 142.35 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -172.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -139.61 153.7 47.41 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.57 2.348 . . . . 0.0 106.36 170.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.7 p -139.81 160.95 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.048 -1.032 . . . . 0.0 109.217 -178.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -133.92 148.06 51.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 161.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.81 128.27 55.7 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.9 mp -119.22 -175.06 2.85 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.482 2.313 . . . . 0.0 107.939 -169.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -62.92 -36.75 84.43 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -165.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -141.56 25.02 2.04 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.524 1.13 . . . . 0.0 112.4 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.63 -170.72 38.82 Favored Glycine 0 CA--C 1.518 0.27 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 mp -136.9 144.57 43.56 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.061 1.344 . . . . 0.0 108.368 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -93.04 145.87 24.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 160.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.71 129.81 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 176.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.58 137.63 49.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 104.03 -2.582 . . . . 0.0 104.03 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.82 134.78 55.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 119.249 0.931 . . . . 0.0 109.452 175.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.3 p -131.61 176.14 8.57 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.16 0.984 . . . . 0.0 110.391 -157.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 66.5 mttt . . . . . 0 N--CA 1.466 0.358 0 C-N-CA 125.645 1.578 . . . . 0.0 111.148 175.774 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -140.05 85.85 2.05 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -150.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 mm -72.35 152.11 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 124.003 0.921 . . . . 0.0 109.357 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -141.98 151.8 42.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.716 1.607 . . . . 0.0 110.178 170.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -113.73 102.43 10.24 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.7 mm -69.04 -53.69 24.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -159.73 -166.6 1.79 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.888 1.675 . . . . 0.0 108.694 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.73 -16.38 60.97 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -126.19 -26.53 3.36 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.643 1.177 . . . . 0.0 112.725 -164.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 73.4 m -115.21 134.76 54.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.553 1.141 . . . . 0.0 108.241 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.6 m -122.44 157.57 27.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 166.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -134.76 168.09 19.66 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 162.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.455 ' CE1' HG22 ' A' ' 44' ' ' VAL . 41.0 p90 -149.77 162.51 40.13 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -117.45 126.76 53.18 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 171.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.8 ttt -115.98 108.26 16.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 125.37 1.468 . . . . 0.0 108.02 -177.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.18 147.89 51.63 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.736 171.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -51.35 -39.33 56.83 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.27 -25.17 71.03 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 118.729 -1.04 . . . . 0.0 113.237 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -70.93 -38.58 72.92 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.773 1.787 . . . . 0.0 110.822 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.1 mt -64.47 -47.27 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -58.93 -43.49 91.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.349 1.459 . . . . 0.0 111.858 174.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.68 -44.98 94.86 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.928 0.891 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -68.62 -5.29 19.17 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.018 0.927 . . . . 0.0 111.733 172.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.75 12.47 84.47 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 124.502 1.049 . . . . 0.0 112.87 175.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -78.58 -175.08 4.15 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 163.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.1 t70 -133.42 144.08 49.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.6 ptt180 -55.36 -33.51 63.47 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.785 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.06 -49.43 15.35 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.778 0.717 . . . . 0.0 109.411 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.405 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.5 mm-40 -59.76 -34.92 73.61 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.973 0.909 . . . . 0.0 112.146 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -49.94 -52.0 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 123.521 0.729 . . . . 0.0 109.566 171.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -65.73 -36.97 85.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.045 0.839 . . . . 0.0 111.243 -177.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -101.29 1.65 38.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -160.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -135.65 91.46 2.71 Favored 'General case' 0 CA--C 1.524 -0.056 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -59.59 -50.78 72.54 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -160.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -31.52 64.72 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 174.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -80.55 -18.51 48.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.52 175.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.96 -52.16 64.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 165.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -52.18 -34.09 43.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.359 1.463 . . . . 0.0 113.098 -168.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -57.52 -37.47 73.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.356 1.063 . . . . 0.0 111.646 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -56.25 24.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.761 0.824 . . . . 0.0 108.92 176.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -62.14 -35.1 77.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.732 0.813 . . . . 0.0 109.888 -176.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 63.9 m95 -65.09 -34.81 79.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.787 -1.101 . . . . 0.0 112.907 171.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -35.62 71.43 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 121.099 1.772 . . . . 0.0 111.277 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.455 HG22 ' CE1' ' A' ' 13' ' ' PHE . 16.7 m -75.02 -36.8 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 121.118 -0.989 . . . . 0.0 111.779 176.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -46.0 80.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 118.986 -0.53 . . . . 0.0 110.255 165.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.67 -34.94 73.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.697 0.681 . . . . 0.0 112.316 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.47 -17.08 11.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 112.578 173.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 30.5 m -134.78 11.67 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.592 1.557 . . . . 0.0 112.46 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -26.65 39.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.526 1.131 . . . . 0.0 113.129 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.63 -22.36 66.36 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -104.6 -39.83 6.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.668 1.187 . . . . 0.0 110.165 173.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -65.71 -21.23 66.51 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.258 -0.877 . . . . 0.0 112.177 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -58.38 -19.98 40.28 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.912 1.687 . . . . 0.0 112.384 171.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -99.7 6.22 45.61 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.415 1.486 . . . . 0.0 111.291 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.82 -4.86 1.05 Allowed 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -173.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -88.12 1.05 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 121.314 1.87 . . . . 0.0 112.397 169.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -57.35 -12.75 2.69 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.217 1.007 . . . . 0.0 112.783 149.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -130.1 -178.21 15.29 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.994 1.759 . . . . 0.0 110.695 176.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.02 177.46 7.73 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.526 2.818 . . . . 0.0 113.172 -166.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.0 tp -141.42 149.63 41.29 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.417 1.487 . . . . 0.0 107.009 166.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -145.1 151.22 38.15 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.255 1.422 . . . . 0.0 107.582 -171.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.6 mm -133.26 144.07 37.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -170.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -140.58 149.94 43.01 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.827 1.651 . . . . 0.0 107.135 163.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.6 155.92 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 120.755 -1.216 . . . . 0.0 110.143 -173.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.71 150.47 36.33 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 161.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.92 148.62 26.14 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 167.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mp -128.89 -177.06 4.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.354 2.662 . . . . 0.0 108.319 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.6 -32.52 73.55 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -169.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.1 mmtm -138.33 19.39 2.76 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.324 1.049 . . . . 0.0 112.663 -176.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 177.5 -164.98 34.46 Favored Glycine 0 C--O 1.225 -0.422 0 O-C-N 121.119 -0.988 . . . . 0.0 111.144 -175.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.5 mp -131.42 145.87 52.0 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.748 1.619 . . . . 0.0 107.264 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -103.19 130.83 50.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 160.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -118.38 128.09 75.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 105.032 -2.211 . . . . 0.0 105.032 178.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -104.41 144.51 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 168.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.87 127.64 40.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -176.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -131.74 170.59 14.6 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 118.902 0.774 . . . . 0.0 111.535 -163.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.5 mttm . . . . . 0 C--O 1.233 0.222 0 C-N-CA 124.991 1.317 . . . . 0.0 109.545 163.009 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 ptm . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.61 72.84 1.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.035 1.334 . . . . 0.0 107.959 -166.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 mm -62.03 151.88 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 124.923 1.289 . . . . 0.0 109.468 175.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -147.67 127.24 13.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.855 1.262 . . . . 0.0 110.147 172.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -82.22 110.38 17.36 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.0 mm -74.53 -55.71 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -156.86 -165.19 1.79 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.406 1.483 . . . . 0.0 108.643 -177.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.68 -20.86 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.14 0.976 . . . . 0.0 113.474 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -124.67 -42.3 2.08 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.966 0.906 . . . . 0.0 111.613 -166.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 55.6 m -92.2 137.85 32.02 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 m -127.07 155.77 38.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 166.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -129.73 171.57 12.53 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 165.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -151.42 152.42 33.04 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -105.56 142.51 35.18 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 166.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.9 ttt -138.24 104.75 5.28 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 125.017 1.327 . . . . 0.0 108.063 -172.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -67.06 154.07 42.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.493 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -51.61 -33.35 32.6 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.23 -11.2 76.26 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 119.897 -1.144 . . . . 0.0 113.41 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -68.69 -40.54 80.03 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.702 1.751 . . . . 0.0 108.846 166.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.4 mt -64.12 -46.38 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.162 1.385 . . . . 0.0 108.698 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.71 -35.3 80.36 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.47 0.308 . . . . 0.0 111.346 -177.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.33 -43.38 98.95 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.362 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.1 mtt-85 -69.35 -7.08 34.15 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.355 1.062 . . . . 0.0 111.455 174.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.62 84.6 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.412 1.006 . . . . 0.0 112.731 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -83.89 -175.13 5.66 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -141.56 148.7 39.73 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -57.01 -36.64 70.66 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.142 0.883 . . . . 0.0 111.397 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -76.06 -45.06 36.1 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.05 -37.06 81.27 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.256 -0.902 . . . . 0.0 111.866 -173.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -54.71 -44.81 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 124.146 0.978 . . . . 0.0 110.126 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -69.79 -26.48 64.29 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -120.98 8.73 10.47 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -157.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -131.48 100.59 5.2 Favored 'General case' 0 N--CA 1.458 -0.057 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -58.18 -16.69 14.48 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -165.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.34 -31.09 6.69 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.53 1.532 . . . . 0.0 111.777 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -77.71 -18.0 57.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.232 0.924 . . . . 0.0 111.124 176.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.3 p -54.39 -55.18 31.24 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.932 0.893 . . . . 0.0 109.329 165.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -56.89 -31.3 64.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.376 1.87 . . . . 0.0 112.865 -169.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -58.94 -36.13 74.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.453 1.101 . . . . 0.0 111.109 -177.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -55.69 29.04 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -62.82 -36.1 82.09 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.095 0.958 . . . . 0.0 109.809 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -62.15 -38.81 90.4 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.765 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.66 -34.74 77.54 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.39 1.45 . . . . 0.0 110.698 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.8 m -77.59 -39.44 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 120.921 -1.112 . . . . 0.0 111.795 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -42.6 77.03 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.846 -0.533 . . . . 0.0 110.098 169.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.44 -40.18 85.96 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.051 0.541 . . . . 0.0 111.849 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -60.8 -11.23 7.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.903 1.281 . . . . 0.0 112.936 173.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -123.04 5.11 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.304 1.842 . . . . 0.0 109.571 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -57.14 -31.9 65.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.245 -1.534 . . . . 0.0 114.031 -166.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.15 -12.75 42.88 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -114.95 -37.28 4.2 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.765 1.626 . . . . 0.0 110.318 175.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -58.66 -29.32 66.49 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.491 -0.755 . . . . 0.0 110.948 174.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -59.18 -13.29 6.92 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.112 1.324 . . . . 0.0 113.863 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -124.86 14.85 8.6 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.665 1.186 . . . . 0.0 111.829 173.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -128.76 -4.16 5.23 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.696 1.198 . . . . 0.0 112.973 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.4 p -78.83 62.11 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 123.362 1.553 . . . . 0.0 110.858 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -159.48 32.37 0.2 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.8 1.24 . . . . 0.0 109.314 -168.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.48 -177.16 38.22 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.753 1.644 . . . . 0.0 109.795 -177.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.6 170.89 16.5 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.294 2.663 . . . . 0.0 111.377 -179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.39 148.41 46.18 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -138.24 148.52 44.83 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.6 mm -139.34 141.41 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -143.78 161.78 37.74 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.664 0.786 . . . . 0.0 109.461 156.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.4 p -152.23 157.76 4.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 O-C-N 121.203 -0.936 . . . . 0.0 109.868 -171.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -144.74 149.56 35.75 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 162.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.41 146.97 32.52 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 165.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.07 -179.18 4.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.103 2.561 . . . . 0.0 108.163 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -62.08 -31.06 71.46 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -166.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.3 mmtm -140.39 22.0 2.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.25 1.02 . . . . 0.0 112.197 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.92 -168.79 37.99 Favored Glycine 0 CA--C 1.519 0.323 0 O-C-N 121.059 -1.026 . . . . 0.0 111.275 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.0 mp -132.38 146.38 51.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 125.793 1.637 . . . . 0.0 107.703 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.81 131.29 52.47 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 160.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -116.15 135.07 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.819 -2.289 . . . . 0.0 104.819 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -111.82 141.96 25.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 165.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.92 144.06 37.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.49 161.71 34.28 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -161.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.3 mppt? . . . . . 0 CA--C 1.534 0.332 0 C-N-CA 125.973 1.709 . . . . 0.0 108.027 174.281 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -143.08 128.01 18.39 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 -150.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.47 150.49 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 120.285 1.402 . . . . 0.0 108.675 -168.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.9 151.51 42.72 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.012 1.325 . . . . 0.0 110.032 174.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.91 103.58 11.08 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.8 mm -69.72 -55.14 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -157.18 -171.41 3.61 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.038 1.735 . . . . 0.0 108.058 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.07 -13.14 14.83 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.56 1.144 . . . . 0.0 113.593 -175.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -123.04 -52.25 1.87 Allowed 'General case' 0 C--N 1.342 0.252 0 O-C-N 121.048 -1.033 . . . . 0.0 110.851 -171.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.0 m -80.93 141.36 34.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -128.81 158.77 41.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.1 pttt -134.84 164.07 28.39 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 164.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -149.85 165.47 32.44 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -124.78 136.62 54.01 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 172.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.3 ttt -133.21 116.34 16.09 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.7 m -76.61 156.57 32.62 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.4 m-85 -55.5 -43.61 75.82 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.207 -0.933 . . . . 0.0 111.908 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.38 -9.85 86.59 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-O 118.587 -1.118 . . . . 0.0 113.451 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -66.02 -36.22 82.67 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.883 1.841 . . . . 0.0 109.062 166.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.94 -41.03 31.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.151 1.38 . . . . 0.0 107.672 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.88 -37.9 83.78 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.349 0.522 . . . . 0.0 111.502 174.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.67 -42.14 91.68 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.878 0.847 . . . . 0.0 110.895 -177.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.7 mtt85 -68.47 -8.99 45.82 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.382 172.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.95 12.98 83.87 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.457 1.027 . . . . 0.0 112.866 177.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.56 -170.74 3.26 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 165.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -142.37 150.92 41.34 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 172.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -60.94 -32.4 71.92 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -169.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -84.84 -42.65 14.89 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -57.86 -36.09 71.85 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 124.092 0.957 . . . . 0.0 112.419 -173.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.2 mm -44.15 -51.55 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.703 1.201 . . . . 0.0 110.586 169.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -78.43 -14.28 59.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.75 7.82 9.96 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -166.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -125.32 99.1 5.91 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.552 1.541 . . . . 0.0 106.958 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -54.82 -20.57 8.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.732 1.613 . . . . 0.0 115.068 -169.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.87 -30.62 9.26 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.963 0.801 . . . . 0.0 112.02 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -78.49 -16.7 57.24 Favored 'General case' 0 C--N 1.338 0.079 0 CA-C-N 118.92 0.782 . . . . 0.0 111.281 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 12.9 p -54.06 -58.56 6.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 166.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.39 -31.42 63.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.438 1.895 . . . . 0.0 112.486 -166.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -59.89 -35.22 74.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 111.307 -176.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -56.86 16.28 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 122.301 1.048 . . . . 0.0 108.548 175.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.25 -37.91 89.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.451 1.1 . . . . 0.0 110.395 -174.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -58.63 -37.0 74.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.969 172.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.52 -43.44 76.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.347 1.431 . . . . 0.0 110.388 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.8 m -71.13 -40.89 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.935 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.7 mmt -58.53 -43.28 89.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 122.802 0.441 . . . . 0.0 110.647 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -60.27 -42.09 94.64 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.584 0.629 . . . . 0.0 111.256 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -64.21 -6.0 5.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.37 1.868 . . . . 0.0 112.161 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -126.77 -0.89 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.635 1.974 . . . . 0.0 109.571 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -57.31 -28.83 63.41 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -161.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.13 -22.26 60.59 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.055 0.843 . . . . 0.0 112.415 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -100.43 -0.91 37.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.065 1.346 . . . . 0.0 111.616 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.12 -20.37 3.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.276 1.03 . . . . 0.0 111.801 -163.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -59.71 -14.48 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.942 1.297 . . . . 0.0 114.316 -174.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -126.01 18.31 7.82 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.522 1.529 . . . . 0.0 110.486 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.24 27.74 1.56 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.143 1.377 . . . . 0.0 112.061 -174.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.28 48.52 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 123.098 1.428 . . . . 0.0 107.716 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -122.35 35.48 4.87 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.469 2.308 . . . . 0.0 108.053 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.77 -177.24 37.2 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 126.418 1.961 . . . . 0.0 109.441 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -69.88 170.93 15.56 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.501 2.8 . . . . 0.0 111.943 -176.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.42 152.37 48.31 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 172.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -148.62 145.04 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.367 1.467 . . . . 0.0 107.185 -163.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.7 mm -135.33 145.41 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -133.21 148.51 52.03 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 158.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.3 p -136.22 157.77 37.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 171.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.403 HE22 HD11 ' A' ' 74' ' ' ILE . 1.2 pm0 -146.25 151.57 37.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 159.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.01 143.54 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -125.78 -171.87 2.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.215 2.606 . . . . 0.0 107.691 -173.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.11 -37.96 84.61 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -166.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.3 mmtm -141.78 27.45 1.83 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.363 1.065 . . . . 0.0 112.379 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.74 -169.07 38.92 Favored Glycine 0 C--O 1.23 -0.139 0 O-C-N 120.929 -1.107 . . . . 0.0 110.478 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mp -135.26 144.35 46.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.222 1.009 . . . . 0.0 109.236 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -93.2 133.93 35.9 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.53 132.1 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.403 HD11 HE22 ' A' ' 65' ' ' GLN . 1.4 mp -112.24 143.31 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 170.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.52 136.33 52.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 118.839 0.745 . . . . 0.0 109.365 171.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -129.69 174.98 9.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.182 0.993 . . . . 0.0 110.146 -160.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 75.7 mttt . . . . . 0 N--CA 1.465 0.283 0 C-N-CA 125.239 1.416 . . . . 0.0 110.721 172.128 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptm . . . . . 0 N--CA 1.496 1.839 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -134.75 130.71 36.62 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.0 mm -122.31 152.24 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 125.057 1.343 . . . . 0.0 108.907 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.01 152.18 46.05 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.12 1.368 . . . . 0.0 110.121 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -119.59 92.61 3.83 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.038 1.735 . . . . 0.0 106.461 177.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.9 -53.51 40.8 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -157.28 -162.98 1.29 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.006 1.722 . . . . 0.0 108.24 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -67.48 -17.12 64.57 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -123.81 -50.26 1.84 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.411 -0.805 . . . . 0.0 110.852 -164.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 27.8 m -81.42 133.07 35.36 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 170.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -128.94 159.9 40.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 163.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.4 pttt -139.13 167.14 22.73 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 164.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -148.95 166.69 27.86 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -125.38 133.99 52.33 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 106.128 -1.805 . . . . 0.0 106.128 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.4 tpt -129.42 107.23 9.34 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -169.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.67 154.62 41.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.9 m-85 -53.52 -37.91 63.26 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.707 -0.621 . . . . 0.0 111.893 175.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.54 -26.08 74.85 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.304 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.81 -30.66 69.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.692 1.746 . . . . 0.0 110.316 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.97 -44.62 28.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -58.9 -39.82 82.62 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 124.835 1.254 . . . . 0.0 111.631 175.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.98 -44.16 97.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.96 0.886 . . . . 0.0 111.257 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 79.3 mtt85 -72.09 -5.6 36.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.677 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 11.64 85.02 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.719 1.152 . . . . 0.0 112.903 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -85.05 -175.09 5.61 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 168.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -135.33 146.54 48.54 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 173.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -52.86 -35.28 57.4 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.991 0.814 . . . . 0.0 111.119 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -80.39 -45.11 18.25 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.537 1.135 . . . . 0.0 108.967 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -61.18 -36.09 78.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.213 1.005 . . . . 0.0 112.319 -176.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.88 -49.87 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -84.21 -26.4 28.76 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -97.39 -17.08 19.92 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.937 0.495 . . . . 0.0 111.316 -167.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.8 -171.48 3.54 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 158.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -135.98 -48.01 0.67 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.186 -0.946 . . . . 0.0 111.136 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -34.64 76.54 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.369 0.668 . . . . 0.0 110.605 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -79.84 -12.54 59.75 Favored 'General case' 0 C--N 1.34 0.182 0 O-C-N 121.49 -0.756 . . . . 0.0 111.925 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.71 -41.5 75.26 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 168.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.577 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 15.7 tt0 -56.28 -30.98 63.19 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.128 1.371 . . . . 0.0 113.013 -171.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.76 -33.5 75.79 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.653 1.981 . . . . 0.0 111.033 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -44.88 92.24 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.577 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -71.12 -40.68 71.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.652 0.781 . . . . 0.0 108.958 -173.885 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -56.45 -40.44 74.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.369 171.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.05 -22.26 65.6 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.396 0.998 . . . . 0.0 113.08 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.3 m -103.99 -38.09 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 119.846 1.203 . . . . 0.0 111.853 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -43.27 64.68 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 163.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.86 -44.64 66.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 123.779 0.832 . . . . 0.0 112.441 173.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -62.62 -7.37 4.64 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 t -129.02 -2.95 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 126.059 1.744 . . . . 0.0 110.003 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -59.99 -29.88 68.75 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.515 -1.365 . . . . 0.0 114.517 -159.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.84 -11.69 40.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.413 0.685 . . . . 0.0 112.46 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -113.82 -31.73 6.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.229 1.812 . . . . 0.0 110.623 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.26 -28.27 67.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.415 1.007 . . . . 0.0 111.009 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.28 -22.31 40.7 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.139 0.881 . . . . 0.0 112.747 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -83.75 -10.65 57.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.904 0.775 . . . . 0.0 112.335 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -138.15 4.83 2.5 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.294 1.038 . . . . 0.0 113.581 -165.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.59 77.6 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-O 122.801 1.286 . . . . 0.0 109.033 174.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -147.82 22.88 1.11 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.918 1.287 . . . . 0.0 110.827 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.25 176.89 42.59 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.796 1.189 . . . . 0.0 110.435 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.74 164.69 33.12 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.798 2.999 . . . . 0.0 112.03 -174.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.1 mt -87.53 158.93 18.8 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 164.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -143.18 141.75 31.23 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.57 143.17 39.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.386 0.994 . . . . 0.0 108.727 -172.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -137.38 155.66 49.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.147 1.379 . . . . 0.0 107.718 165.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.91 160.21 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 O-C-N 120.744 -1.222 . . . . 0.0 110.178 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -141.05 152.15 44.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 157.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.0 143.59 30.95 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.131 0.573 . . . . 0.0 109.618 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -125.93 -175.6 3.4 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.255 2.622 . . . . 0.0 107.599 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.9 -35.54 80.38 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -164.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.6 mmtm -141.07 25.54 2.09 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 112.14 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.91 -173.45 42.49 Favored Glycine 0 C--O 1.228 -0.27 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -175.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.52 144.86 46.54 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.478 1.111 . . . . 0.0 108.82 177.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -94.54 129.49 41.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 161.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.95 127.24 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mp -95.8 147.09 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 166.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.97 139.99 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 172.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -134.94 168.47 19.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.097 0.959 . . . . 0.0 108.622 -173.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 mppt? -144.68 151.51 39.04 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.505 1.122 . . . . 0.0 109.903 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.74 -24.16 66.9 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 112.783 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -57.57 -23.68 51.98 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.773 0.829 . . . . 0.0 112.169 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.0 tp -50.26 -29.37 9.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.93 172.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.5 m -129.75 32.9 4.52 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.011 1.324 . . . . 0.0 110.492 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -60.7 -46.81 88.96 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.562 -0.711 . . . . 0.0 109.486 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -75.42 123.08 24.79 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 163.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 tp -159.68 -44.39 0.05 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.607 0.763 . . . . 0.0 110.53 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -59.86 -26.71 66.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -173.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -68.05 -23.58 64.98 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -76.67 140.49 40.93 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 119.123 0.874 . . . . 0.0 108.723 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.4 158.95 62.55 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 125.296 1.438 . . . . 0.0 108.125 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -84.51 30.63 0.51 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.296 3.331 . . . . 0.0 112.601 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.614 1.966 . . . . 0.0 108.213 -172.848 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.737 0.303 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -124.98 77.95 1.66 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -160.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 mm -68.43 150.45 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.763 1.225 . . . . 0.0 109.327 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -151.66 102.25 2.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.355 1.062 . . . . 0.0 110.226 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -72.78 118.38 15.65 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.267 -1.521 . . . . 0.0 106.907 171.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 32.9 mm -81.92 -53.54 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -163.62 -175.14 4.01 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.894 1.677 . . . . 0.0 108.873 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.08 -14.99 1.81 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.366 1.467 . . . . 0.0 114.931 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -119.19 -27.26 5.71 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.265 1.426 . . . . 0.0 112.802 -167.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -129.81 140.79 50.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.457 1.103 . . . . 0.0 109.27 -172.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.8 m -130.07 153.64 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 106.219 -1.771 . . . . 0.0 106.219 166.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -132.29 168.31 18.31 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 168.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.447 ' CE1' HG22 ' A' ' 44' ' ' VAL . 40.8 p90 -155.0 165.17 37.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -118.69 140.91 49.17 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -132.38 112.13 11.91 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.9 m -73.19 156.97 38.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.1 m-85 -52.06 -43.44 63.81 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 121.985 -0.447 . . . . 0.0 111.745 173.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -78.81 -12.07 84.57 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 119.707 -1.235 . . . . 0.0 113.817 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -34.39 75.54 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.688 1.744 . . . . 0.0 109.422 165.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.15 -42.11 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -61.33 -37.54 83.65 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.735 0.698 . . . . 0.0 111.515 175.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.47 -42.51 98.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.838 0.828 . . . . 0.0 110.898 -176.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -72.39 -4.83 32.44 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.564 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.62 11.19 85.52 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.479 1.038 . . . . 0.0 113.071 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -82.86 -173.13 4.5 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 168.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -138.53 147.05 42.67 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 174.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.6 ptt85 -56.93 -35.5 69.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.676 0.671 . . . . 0.0 111.597 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.62 -45.52 29.8 Favored 'General case' 0 C--O 1.226 -0.147 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.97 -37.02 78.39 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 121.429 -0.795 . . . . 0.0 111.838 -172.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -53.32 -47.43 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.58 0.752 . . . . 0.0 109.947 171.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 m95 -68.64 -21.71 64.45 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.266 0.939 . . . . 0.0 112.943 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -120.56 4.06 10.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -161.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -137.87 83.56 1.99 Allowed 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -47.43 -42.77 23.06 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.58 -32.09 63.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.479 -0.763 . . . . 0.0 111.288 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -77.82 -19.66 54.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.95 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -51.96 64.89 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 166.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -52.42 -34.37 48.1 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.229 1.412 . . . . 0.0 113.228 -169.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.4 -36.56 69.06 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.797 1.239 . . . . 0.0 111.646 -179.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -53.06 62.63 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.093 0.957 . . . . 0.0 109.069 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -66.36 -32.42 73.8 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.398 1.079 . . . . 0.0 110.66 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -65.26 -44.43 88.12 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.889 170.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.94 -41.56 95.41 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.079 1.309 . . . . 0.0 110.878 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.447 HG22 ' CE1' ' A' ' 13' ' ' PHE . 27.9 m -68.96 -44.01 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 O-C-N 121.251 -0.906 . . . . 0.0 112.147 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 43.9 tpp -59.35 -39.56 83.63 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.03 -38.33 88.29 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.529 -0.732 . . . . 0.0 111.894 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.16 -13.8 41.38 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.52 1.528 . . . . 0.0 113.221 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 33.6 m -123.33 -5.34 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.361 1.064 . . . . 0.0 111.939 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -18.15 12.08 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -66.1 -16.9 64.34 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 120.277 1.399 . . . . 0.0 112.437 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -113.63 -36.88 4.76 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.483 0.713 . . . . 0.0 110.87 162.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -68.1 -13.07 61.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 118.003 -0.999 . . . . 0.0 112.473 -175.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -57.13 -27.41 61.82 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.486 1.494 . . . . 0.0 112.029 168.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -79.42 -5.87 55.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.285 0.634 . . . . 0.0 111.998 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.02 36.96 1.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.641 1.176 . . . . 0.0 111.205 -166.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.8 p -117.47 66.04 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 123.628 1.68 . . . . 0.0 106.577 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -153.18 36.41 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 113.942 -1.481 . . . . 0.0 109.251 -168.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.45 -176.25 39.21 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 126.087 1.803 . . . . 0.0 109.753 -173.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.45 170.07 12.95 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.459 2.773 . . . . 0.0 110.905 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -137.36 147.57 45.61 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -143.74 144.19 31.72 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.557 1.543 . . . . 0.0 107.281 -164.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.8 mm -137.19 138.1 45.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -170.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -136.28 147.66 47.6 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.441 1.896 . . . . 0.0 107.641 169.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.37 154.74 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 O-C-N 120.975 -1.078 . . . . 0.0 109.671 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -144.85 150.22 36.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 161.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.68 146.94 26.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 169.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.67 179.81 5.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.976 2.51 . . . . 0.0 108.315 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -58.39 -36.48 73.62 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -168.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 34.0 mmtp -139.16 27.14 2.37 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.119 0.967 . . . . 0.0 112.329 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.08 -168.32 37.38 Favored Glycine 0 CA--C 1.521 0.409 0 O-C-N 121.005 -1.059 . . . . 0.0 111.692 -174.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -133.0 145.19 50.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.112 1.765 . . . . 0.0 107.516 176.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -103.09 136.52 42.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 159.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -123.58 131.38 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 178.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -111.84 136.51 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 168.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 4.2 m -131.08 141.94 44.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 119.569 1.077 . . . . 0.0 108.696 172.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.2 p -134.38 162.91 30.89 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -161.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 162.67 36.03 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.28 1.832 . . . . 0.0 107.492 174.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.98 146.67 46.13 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -70.73 170.16 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.126 0.57 . . . . 0.0 109.967 171.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 56.3 tp -136.71 152.88 50.87 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 171.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 p -61.97 -10.56 10.02 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -169.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -53.92 -47.51 71.13 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.265 0.939 . . . . 0.0 109.29 165.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -82.74 45.45 0.99 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.189 1.795 . . . . 0.0 110.335 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.7 tt -148.64 -55.19 0.2 Allowed 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 174.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -69.49 -40.06 77.25 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 122.357 0.263 . . . . 0.0 111.289 177.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -124.17 175.6 6.92 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.898 2.079 . . . . 0.0 109.802 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 69.9 mt -77.83 168.79 19.37 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 156.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 158.76 74.77 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 123.906 0.882 . . . . 0.0 109.228 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.66 149.45 32.07 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.777 2.985 . . . . 0.0 113.743 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 . . . . . 0 C--O 1.253 1.261 0 CA-C-N 114.572 -1.195 . . . . 0.0 108.57 163.458 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ptm . . . . . 0 N--CA 1.495 1.805 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.81 76.93 1.24 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.155 1.382 . . . . 0.0 107.794 -161.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -66.83 153.01 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 124.523 1.129 . . . . 0.0 109.599 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -146.76 138.17 24.3 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.972 1.309 . . . . 0.0 109.413 168.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mmt85 -89.85 126.45 35.71 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.98 -1.075 . . . . 0.0 108.142 166.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.1 mm -83.01 -61.94 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 172.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -153.55 17.7 0.53 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 111.526 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 74.16 -34.63 0.28 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 128.074 2.549 . . . . 0.0 113.603 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -68.56 -38.48 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.428 1.013 . . . . 0.0 108.859 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.1 m -110.12 140.4 44.24 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.642 1.577 . . . . 0.0 107.484 168.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 m -129.1 162.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 166.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -135.39 172.74 12.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.763 -1.211 . . . . 0.0 109.683 165.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -144.8 160.55 41.08 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 168.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -118.27 149.5 41.02 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 162.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 4.8 ttt -144.64 103.41 3.93 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 -168.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.8 m -67.48 153.19 44.27 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.9 m-85 -53.12 -31.63 43.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.81 -25.51 73.06 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-O 119.066 -0.852 . . . . 0.0 113.663 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.86 -37.0 75.98 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.757 1.779 . . . . 0.0 109.739 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 11.3 mt -68.49 -44.71 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.405 1.482 . . . . 0.0 109.178 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -58.46 -38.92 78.55 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.587 1.155 . . . . 0.0 111.439 174.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.66 -40.7 97.86 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.518 0.675 . . . . 0.0 111.69 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtt-85 -68.51 -11.84 60.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.016 1.327 . . . . 0.0 111.27 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.51 3.19 78.36 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.61 1.576 . . . . 0.0 112.179 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -90.19 -178.41 5.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.788 1.235 . . . . 0.0 110.081 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -137.89 153.33 49.55 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -60.65 -31.92 71.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.467 -170.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -81.79 -46.26 14.44 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -56.83 -35.73 69.16 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.0 0.92 . . . . 0.0 112.751 -171.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.1 mm -44.39 -53.49 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.604 1.162 . . . . 0.0 109.339 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 50.1 m95 -75.01 -17.07 60.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -115.33 8.95 15.53 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.328 0.651 . . . . 0.0 112.334 -165.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -142.03 92.42 2.44 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -50.86 -46.97 60.51 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.556 1.071 . . . . 0.0 112.655 -166.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.01 -21.52 65.94 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.565 -0.71 . . . . 0.0 111.515 -176.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -98.67 -5.63 31.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.062 1.345 . . . . 0.0 111.632 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.92 -49.85 14.63 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -55.78 -32.74 63.74 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.538 1.135 . . . . 0.0 112.921 -170.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -53.15 -37.13 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.798 0.839 . . . . 0.0 111.848 174.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -59.07 6.0 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -64.24 -40.02 95.16 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.073 1.349 . . . . 0.0 110.335 -173.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -61.13 -36.92 81.03 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 117.729 -1.129 . . . . 0.0 112.434 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -72.42 -37.18 68.7 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.669 1.577 . . . . 0.0 111.549 178.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.6 m -70.47 -41.45 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 120.006 1.276 . . . . 0.0 111.152 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -42.08 87.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.934 -0.479 . . . . 0.0 110.445 170.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -58.06 -40.89 82.11 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 122.757 0.423 . . . . 0.0 111.269 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.57 -5.25 2.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.927 1.691 . . . . 0.0 112.78 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.5 t -131.94 2.76 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 126.404 1.881 . . . . 0.0 109.895 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -55.76 -37.47 68.57 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.162 -1.587 . . . . 0.0 113.985 -162.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.38 -8.76 27.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -119.06 -36.13 3.47 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.787 2.035 . . . . 0.0 109.901 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -57.17 -31.85 65.82 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.931 0.892 . . . . 0.0 110.984 170.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -57.39 -21.98 39.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.68 1.127 . . . . 0.0 112.854 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -83.97 -14.23 51.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.893 0.77 . . . . 0.0 112.381 176.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.95 -0.42 3.1 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -165.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.57 69.27 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 122.994 1.378 . . . . 0.0 110.404 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -155.73 27.73 0.38 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.062 1.345 . . . . 0.0 110.195 -173.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.44 -178.82 38.82 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.021 1.296 . . . . 0.0 110.557 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.9 169.49 18.97 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.762 2.975 . . . . 0.0 111.962 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.4 tp -129.72 148.15 51.57 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.48 1.512 . . . . 0.0 107.12 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -140.02 146.87 39.58 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -170.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -135.52 142.76 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -140.13 91.21 2.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.95 1.3 . . . . 0.0 108.196 165.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.82 154.59 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.521 0.728 . . . . 0.0 109.078 166.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.0 152.05 32.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 152.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.57 143.29 32.93 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 123.612 0.765 . . . . 0.0 109.883 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 mp -129.46 -176.03 3.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.968 2.507 . . . . 0.0 108.306 -172.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.04 -34.77 76.87 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.431 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -140.42 21.69 2.38 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.303 1.041 . . . . 0.0 112.355 -177.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.9 -170.15 40.48 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mp -134.74 142.62 46.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.863 1.265 . . . . 0.0 109.262 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -94.57 143.5 26.37 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 162.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.93 123.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.4 mp -92.42 145.64 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 104.675 -2.343 . . . . 0.0 104.675 167.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.65 131.73 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.84 159.41 39.89 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -165.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 mppt? -145.55 165.66 27.99 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 126.97 2.108 . . . . 0.0 108.39 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.25 160.66 10.13 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 164.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -59.43 146.24 40.82 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.828 0.451 . . . . 0.0 110.375 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.6 -32.82 74.63 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.027 0.531 . . . . 0.0 110.627 175.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 p -73.87 42.4 0.14 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.532 1.933 . . . . 0.0 111.782 172.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -54.89 -32.37 60.86 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.32 1.448 . . . . 0.0 110.907 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -139.69 176.18 8.95 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 155.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 57.9 tp -152.72 -42.01 0.1 Allowed 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.583 1.153 . . . . 0.0 110.085 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.86 -33.65 76.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.367 0.53 . . . . 0.0 111.482 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -95.33 36.67 1.22 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.0 0.92 . . . . 0.0 111.1 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 159.5 2.45 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 122.747 0.419 . . . . 0.0 111.584 169.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 m -139.79 160.29 61.54 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.227 1.411 . . . . 0.0 108.783 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.82 156.72 14.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.933 3.089 . . . . 0.0 113.264 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 93.4 mtt-85 . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.471 -0.776 . . . . 0.0 108.974 169.789 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.797 0.332 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -127.4 78.09 1.79 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -151.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 mp -76.8 153.71 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.494 1.118 . . . . 0.0 109.772 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -134.69 156.14 49.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.312 2.245 . . . . 0.0 108.154 170.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -124.29 89.34 3.06 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 176.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.0 -52.83 56.55 Favored 'Isoleucine or valine' 0 C--N 1.345 0.399 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -157.14 -164.1 1.53 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.189 1.796 . . . . 0.0 107.206 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -72.49 -9.93 59.17 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -176.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -126.6 -40.63 1.91 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.042 -1.036 . . . . 0.0 112.184 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.8 m -92.86 134.53 34.99 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 165.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 m -128.88 156.55 41.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 165.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -142.13 169.66 17.18 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 121.018 -1.052 . . . . 0.0 108.558 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.417 ' CD1' HG22 ' A' ' 44' ' ' VAL . 38.1 p90 -153.52 163.62 39.65 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 172.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -115.31 143.12 45.74 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -136.85 108.24 6.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.81 1.244 . . . . 0.0 107.872 -175.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -68.1 153.94 42.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-30 -52.2 -38.7 58.66 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 122.851 0.461 . . . . 0.0 112.121 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.79 -25.52 70.58 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 119.24 -0.755 . . . . 0.0 113.385 -177.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -69.31 -38.71 78.38 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.995 1.397 . . . . 0.0 109.979 175.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.54 -43.56 71.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 125.452 1.501 . . . . 0.0 108.345 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.92 -40.84 85.75 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.03 1.332 . . . . 0.0 111.581 175.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -62.85 -42.06 99.6 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.566 0.698 . . . . 0.0 111.237 -177.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -68.46 -13.19 62.14 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.916 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.1 13.32 83.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.734 1.159 . . . . 0.0 112.953 -176.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -82.86 -173.74 4.85 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.407 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.4 t70 -141.89 147.49 37.21 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -53.72 -35.77 61.54 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.834 0.743 . . . . 0.0 111.443 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.78 -42.1 25.15 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.313 0.506 . . . . 0.0 109.863 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.407 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.92 -37.71 85.68 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.05 -1.031 . . . . 0.0 111.058 -175.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.63 -43.87 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.797 1.239 . . . . 0.0 110.254 170.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.59 -28.35 66.86 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.121 0.873 . . . . 0.0 113.057 177.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -120.92 8.79 10.51 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -155.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -132.18 98.17 4.34 Favored 'General case' 0 C--N 1.335 -0.053 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.2 ttp85 -54.27 -23.45 15.04 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.245 1.418 . . . . 0.0 114.74 -169.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 -31.16 10.69 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 118.902 0.774 . . . . 0.0 111.864 178.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -79.83 -17.47 53.2 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.068 0.849 . . . . 0.0 111.316 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 p -59.35 -53.3 59.81 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 167.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -30.94 63.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.316 1.846 . . . . 0.0 113.25 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -58.54 -34.29 70.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.53 1.132 . . . . 0.0 111.165 -178.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -52.71 64.54 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 122.501 1.143 . . . . 0.0 109.023 175.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -67.82 -33.3 74.52 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.806 0.843 . . . . 0.0 109.851 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -63.23 -29.9 71.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.578 172.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -76.52 -45.11 32.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.289 1.404 . . . . 0.0 108.843 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.417 HG22 ' CD1' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -61.94 -49.33 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 36.8 tpp -63.81 -34.8 78.72 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.54 -177.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.04 -41.03 82.4 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 119.061 0.846 . . . . 0.0 111.212 174.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -35.78 78.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.768 0.427 . . . . 0.0 111.178 175.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.99 -13.06 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.088 178.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -60.01 -30.41 69.13 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -152.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -62.25 -21.09 64.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.12 0.873 . . . . 0.0 112.268 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -96.46 -1.66 46.94 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.629 1.572 . . . . 0.0 110.924 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -135.61 -15.74 1.83 Allowed 'General case' 0 C--N 1.338 0.092 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -158.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.58 -10.22 4.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.298 1.039 . . . . 0.0 113.293 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -117.46 13.76 14.49 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.88 2.072 . . . . 0.0 111.365 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.59 -22.99 1.65 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.924 1.29 . . . . 0.0 113.074 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -70.81 -4.29 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 120.638 1.563 . . . . 0.0 113.728 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -55.23 -20.62 11.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.517 1.527 . . . . 0.0 114.021 159.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -93.32 -173.39 40.24 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.637 1.113 . . . . 0.0 112.661 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -68.55 173.18 10.23 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.584 2.856 . . . . 0.0 111.08 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.1 mt -146.22 149.96 34.91 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.636 1.175 . . . . 0.0 108.431 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -147.7 148.01 30.56 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.165 1.386 . . . . 0.0 108.012 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 2.4 mm -135.51 149.4 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -138.82 143.5 38.9 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 161.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.4 p -147.76 157.06 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 O-C-N 120.405 -1.435 . . . . 0.0 109.876 -168.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -149.78 150.98 32.83 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 167.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.66 145.27 29.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 164.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -126.23 -179.8 4.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.779 2.432 . . . . 0.0 107.858 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.08 -32.26 71.91 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -166.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.0 mmtm -140.64 23.08 2.31 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.214 1.005 . . . . 0.0 112.227 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.16 -170.24 38.62 Favored Glycine 0 C--N 1.332 0.325 0 O-C-N 120.917 -1.114 . . . . 0.0 110.895 -173.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.6 mp -131.06 148.15 52.71 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.744 1.617 . . . . 0.0 107.297 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -105.38 136.12 45.5 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 158.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -127.05 120.36 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 105.007 -2.22 . . . . 0.0 105.007 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -102.61 143.65 14.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 104.634 -2.358 . . . . 0.0 104.634 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.15 141.05 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 172.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -135.92 164.2 28.51 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.361 0.664 . . . . 0.0 109.676 -165.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.29 163.05 38.22 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.655 1.582 . . . . 0.0 108.158 172.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.29 158.16 21.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -63.9 132.16 49.91 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.7 tp -64.52 -34.31 77.94 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.234 0.614 . . . . 0.0 109.956 174.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -70.76 12.94 0.22 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.577 1.951 . . . . 0.0 114.095 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.81 -29.83 42.4 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.915 0.886 . . . . 0.0 111.136 172.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -134.16 167.25 21.0 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 158.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 50.8 tp -152.63 -34.13 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.062 1.345 . . . . 0.0 110.287 -176.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.02 -41.71 92.76 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.012 0.525 . . . . 0.0 110.495 169.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -79.31 115.13 18.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 164.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 45.6 mt -67.83 160.44 28.33 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.349 1.059 . . . . 0.0 110.067 173.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.5 m -63.73 158.63 59.24 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 162.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.37 154.72 14.17 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 124.0 3.133 . . . . 0.0 113.522 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 126.398 1.879 . . . . 0.0 107.432 179.049 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptm . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -127.55 79.61 1.9 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -152.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 mm -75.06 152.07 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 124.732 1.213 . . . . 0.0 109.804 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -141.95 148.35 38.49 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.579 1.952 . . . . 0.0 108.508 167.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.37 102.53 9.01 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.2 mm -70.93 -56.03 12.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 -170.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -162.61 -171.37 2.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.792 1.637 . . . . 0.0 108.84 -177.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.28 -6.12 8.91 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -118.91 -31.06 4.88 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.937 1.295 . . . . 0.0 111.601 -169.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.0 m -129.5 140.18 51.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.465 1.106 . . . . 0.0 109.278 -170.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.69 155.53 41.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 166.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -136.85 167.79 20.8 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.411 ' CE1' HG23 ' A' ' 44' ' ' VAL . 34.1 p90 -155.49 164.13 39.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.608 0.718 . . . . 0.0 109.351 172.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -114.93 142.61 46.36 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -136.43 115.53 12.42 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -72.77 158.66 35.15 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.442 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -53.61 -42.19 67.44 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 121.784 -0.573 . . . . 0.0 111.423 171.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.84 -27.05 69.51 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.167 -0.796 . . . . 0.0 113.043 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.92 -31.48 69.28 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.446 1.623 . . . . 0.0 110.778 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.8 mt -79.0 -43.97 24.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.837 1.255 . . . . 0.0 107.796 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -58.68 -40.71 84.36 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.289 1.436 . . . . 0.0 111.861 173.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.37 -44.62 95.44 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.165 0.986 . . . . 0.0 111.47 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -69.52 -6.88 33.63 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.578 173.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 12.91 84.16 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.465 1.031 . . . . 0.0 113.07 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -82.28 -174.28 5.04 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -137.35 144.65 42.64 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -55.63 -35.49 65.97 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.249 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -76.74 -44.49 33.01 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 118.708 0.686 . . . . 0.0 109.611 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.02 -37.7 83.49 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 121.389 -0.819 . . . . 0.0 111.311 -173.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -54.2 -45.82 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.78 0.832 . . . . 0.0 109.909 171.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -68.37 -22.2 64.67 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.452 1.024 . . . . 0.0 113.14 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -121.9 3.81 9.97 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -160.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -137.75 82.22 1.91 Allowed 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -178.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -46.28 -43.36 15.65 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.191 0.996 . . . . 0.0 113.654 -166.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.23 -32.21 64.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.684 -0.635 . . . . 0.0 111.683 -177.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -77.78 -20.39 53.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.647 -0.692 . . . . 0.0 110.968 174.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -52.72 62.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 166.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -52.59 -34.1 49.25 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.681 1.592 . . . . 0.0 113.311 -168.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -55.74 -36.32 67.13 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.979 1.311 . . . . 0.0 111.51 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -57.69 11.94 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.437 1.095 . . . . 0.0 108.829 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -62.6 -35.5 79.73 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.962 1.305 . . . . 0.0 110.033 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -62.87 -39.37 94.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.114 171.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -68.35 -41.88 80.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.31 1.414 . . . . 0.0 110.232 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.411 HG23 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -68.72 -42.25 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 121.331 -0.856 . . . . 0.0 111.458 -178.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.9 mmt -54.5 -48.58 71.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.177 0.591 . . . . 0.0 109.674 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.74 -41.32 90.71 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 122.521 0.329 . . . . 0.0 111.498 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -65.53 -12.54 53.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.195 1.798 . . . . 0.0 112.488 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.64 1.16 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.266 1.026 . . . . 0.0 111.778 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.55 -20.82 65.05 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -163.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.04 -20.84 60.01 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.403 1.001 . . . . 0.0 112.13 173.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -103.72 5.96 36.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.138 1.375 . . . . 0.0 111.144 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.16 -20.95 4.74 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.806 1.243 . . . . 0.0 111.93 -173.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.51 -18.58 59.73 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.277 1.031 . . . . 0.0 113.768 -173.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -102.88 3.57 36.7 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.272 1.429 . . . . 0.0 111.761 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.71 40.91 1.3 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.123 1.769 . . . . 0.0 109.869 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.94 66.61 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -153.89 37.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 113.513 -1.676 . . . . 0.0 108.86 -168.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.9 -175.31 35.53 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 126.099 1.809 . . . . 0.0 109.906 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.44 172.27 12.63 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.5 2.8 . . . . 0.0 111.465 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 35.6 mt -135.65 154.18 51.39 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.219 1.408 . . . . 0.0 107.955 171.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.9 m95 -149.2 145.7 27.26 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 125.245 1.418 . . . . 0.0 107.519 -164.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -134.82 143.71 36.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -175.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -137.6 147.44 45.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.083 1.753 . . . . 0.0 106.67 165.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.1 p -150.39 155.66 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 120.647 -1.283 . . . . 0.0 109.719 -170.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -148.95 150.63 33.2 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 164.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.19 146.16 26.12 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 167.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.32 -177.49 4.09 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.779 2.432 . . . . 0.0 108.045 177.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.51 -33.8 73.16 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.442 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -139.6 23.6 2.48 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.464 1.106 . . . . 0.0 112.607 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -179.53 -165.26 33.34 Favored Glycine 0 CA--C 1.521 0.444 0 O-C-N 121.11 -0.994 . . . . 0.0 111.624 -173.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 mp -132.48 148.55 52.4 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.939 1.696 . . . . 0.0 108.041 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -103.33 138.62 39.84 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 156.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -127.2 129.14 70.89 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.026 0 N-CA-C 104.92 -2.252 . . . . 0.0 104.92 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -112.17 141.98 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 170.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.0 m -135.9 138.39 47.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 121.243 -0.911 . . . . 0.0 108.549 171.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -133.75 166.87 21.63 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.169 0.588 . . . . 0.0 110.726 -160.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -137.43 168.85 18.82 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.164 1.786 . . . . 0.0 110.241 167.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.47 144.05 43.56 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.172 171.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -72.89 172.42 10.91 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.104 0.962 . . . . 0.0 110.587 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 21.4 tp -133.14 37.86 3.37 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.031 1.333 . . . . 0.0 109.456 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -13.21 9.85 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.022 1.329 . . . . 0.0 114.066 -175.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -54.22 -30.73 51.04 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.001 1.273 . . . . 0.0 111.429 168.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.65 -8.11 5.99 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.094 1.358 . . . . 0.0 113.518 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.7 mt -129.74 -40.99 1.35 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.938 1.695 . . . . 0.0 110.021 -173.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.42 -31.98 71.7 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.606 0.762 . . . . 0.0 111.575 176.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -100.9 158.65 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.135 0.574 . . . . 0.0 109.523 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.91 151.4 47.19 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 172.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.2 m -140.12 159.26 64.79 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.576 1.55 . . . . 0.0 107.519 177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.19 163.24 35.3 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.555 2.17 . . . . 0.0 111.489 -176.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.256 1.397 0 C-N-CA 123.74 0.816 . . . . 0.0 108.805 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -146.03 136.95 24.46 Favored 'General case' 0 C--O 1.224 -0.274 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 -164.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.05 150.73 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 120.589 1.54 . . . . 0.0 107.95 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.88 151.91 41.56 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.699 1.2 . . . . 0.0 111.013 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 tpp85 -117.68 87.15 2.65 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.651 1.98 . . . . 0.0 106.105 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -57.1 -53.38 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.78 0.8 . . . . 0.0 109.166 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -152.85 -165.93 2.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.009 2.124 . . . . 0.0 106.32 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -78.25 0.41 25.35 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -128.97 -47.74 1.23 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.042 0.937 . . . . 0.0 111.931 -172.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 60.5 m -81.99 135.55 35.35 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 170.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.05 157.69 41.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 165.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -136.31 167.54 21.12 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 168.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.436 ' CE1' HG23 ' A' ' 44' ' ' VAL . 48.7 p90 -149.2 165.35 32.13 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 175.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -127.53 128.74 46.17 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 3.7 ttt -123.78 117.0 23.91 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.928 1.291 . . . . 0.0 108.28 -170.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.6 m -78.09 153.54 32.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.43 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.4 m-85 -58.36 -36.45 73.49 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.329 -0.857 . . . . 0.0 112.171 176.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.94 -29.8 75.76 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-O 119.456 -0.636 . . . . 0.0 112.238 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.47 -37.28 74.25 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.86 1.33 . . . . 0.0 110.474 177.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 33.0 mt -67.1 -48.84 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.803 1.241 . . . . 0.0 109.266 178.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -58.65 -38.98 79.29 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 125.467 1.507 . . . . 0.0 110.954 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.99 -41.12 91.51 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.989 0.899 . . . . 0.0 110.629 -175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.1 mtt85 -67.76 -9.19 41.85 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.174 1.39 . . . . 0.0 111.865 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.3 11.13 82.66 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.692 1.139 . . . . 0.0 113.014 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -86.38 -174.64 5.13 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 166.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -141.33 153.64 45.24 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.112 -0.992 . . . . 0.0 108.344 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -64.73 -28.5 69.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -167.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -87.19 -44.68 11.3 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -57.32 -35.77 70.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 112.95 -171.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.23 -55.8 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.895 1.278 . . . . 0.0 109.344 168.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -76.63 -14.16 60.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -119.87 6.52 10.9 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.899 0.88 . . . . 0.0 112.517 -167.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -129.0 86.22 2.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 170.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -52.27 -35.1 49.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -163.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -31.83 40.58 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.09 0.556 . . . . 0.0 111.672 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -79.94 -16.32 55.51 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.175 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.16 -50.58 72.6 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 167.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -54.62 -31.99 58.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -168.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.19 -36.23 74.98 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.016 1.326 . . . . 0.0 111.228 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -57.84 10.94 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.32 1.048 . . . . 0.0 108.701 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -63.03 -34.19 77.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.153 0.981 . . . . 0.0 110.454 -173.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -62.88 -35.89 81.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.503 -0.76 . . . . 0.0 112.516 173.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.98 -43.71 70.91 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 120.091 1.314 . . . . 0.0 110.522 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.436 HG23 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.98 -37.99 70.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 O-C-N 121.163 -0.96 . . . . 0.0 111.526 -178.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 19.5 tpp -62.74 -39.72 94.99 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.064 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -57.84 -38.61 75.96 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 120.171 1.35 . . . . 0.0 111.561 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.92 -9.96 2.18 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.658 1.583 . . . . 0.0 113.541 173.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.2 t -129.27 -9.25 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 126.3 1.84 . . . . 0.0 110.54 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.03 -28.25 69.96 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.843 -1.161 . . . . 0.0 113.984 -157.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -60.7 -16.09 35.77 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.745 0.702 . . . . 0.0 112.396 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -114.14 6.79 16.44 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.167 1.787 . . . . 0.0 110.803 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -132.73 -18.33 2.43 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.886 1.274 . . . . 0.0 112.557 -172.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.9 -23.17 60.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.567 1.076 . . . . 0.0 112.993 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -98.75 5.6 47.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.8 1.64 . . . . 0.0 111.82 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.17 -15.72 2.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.067 1.347 . . . . 0.0 112.927 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.75 3.04 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 120.282 1.401 . . . . 0.0 113.697 173.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -57.16 -19.7 21.96 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.241 1.017 . . . . 0.0 113.077 155.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -107.97 -177.84 22.18 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.233 1.397 . . . . 0.0 111.762 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.02 170.16 19.6 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.614 2.876 . . . . 0.0 112.803 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.6 tp -144.32 153.76 42.33 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.121 1.768 . . . . 0.0 106.499 169.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -142.0 151.6 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.679 1.592 . . . . 0.0 107.05 -173.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mm -139.27 139.22 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -170.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.22 167.53 22.2 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.793 1.237 . . . . 0.0 109.439 161.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.1 p -144.23 160.16 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.503 0.721 . . . . 0.0 109.864 -169.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -131.31 146.23 52.21 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 127.088 2.155 . . . . 0.0 105.574 163.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.66 129.92 55.34 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 167.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.9 mp -118.7 -169.97 1.82 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 127.083 2.153 . . . . 0.0 108.272 -169.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.24 -43.2 96.28 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.43 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.9 mmtp -142.09 25.3 1.93 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.705 1.202 . . . . 0.0 112.367 -177.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -174.49 -170.52 37.78 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mp -135.53 143.54 45.8 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.889 1.276 . . . . 0.0 108.454 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -93.14 141.23 28.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 161.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -127.88 128.4 69.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -117.13 134.59 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 103.955 -2.609 . . . . 0.0 103.955 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 9.6 m -132.55 134.96 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.2 p -132.34 174.75 9.91 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.682 0.793 . . . . 0.0 110.573 -155.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -131.99 170.55 14.76 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 124.714 1.205 . . . . 0.0 111.566 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.73 171.99 7.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.959 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -134.06 166.94 21.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.701 1.6 . . . . 0.0 108.447 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.9 tp -134.49 32.34 3.35 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.491 1.117 . . . . 0.0 110.355 -172.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 m -74.72 45.03 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.833 1.653 . . . . 0.0 111.787 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -60.03 -21.18 61.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.388 1.075 . . . . 0.0 112.41 177.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -135.83 152.33 50.95 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 161.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.5 tp -162.24 -34.89 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.806 1.643 . . . . 0.0 109.768 -172.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -68.56 -38.01 80.39 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.116 0.566 . . . . 0.0 111.549 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -94.1 167.72 11.39 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.518 0.675 . . . . 0.0 109.225 167.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.3 tp -145.6 157.77 43.93 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.461 1.104 . . . . 0.0 109.485 -168.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.42 159.2 71.54 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.309 1.444 . . . . 0.0 107.769 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.89 164.92 32.49 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.646 2.231 . . . . 0.0 111.425 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 . . . . . 0 C--O 1.255 1.385 0 C-N-CA 123.786 0.834 . . . . 0.0 109.74 172.893 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ptm . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -130.02 130.22 44.68 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.457 1.503 . . . . 0.0 106.988 -169.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -122.63 153.1 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.967 1.258 . . . . 0.0 108.93 -171.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -142.18 151.73 42.48 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.931 1.292 . . . . 0.0 110.797 173.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -113.88 90.21 3.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.22 1.808 . . . . 0.0 106.504 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.5 mm -58.84 -53.03 53.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.981 0.896 . . . . 0.0 109.03 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -152.58 -166.97 2.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.488 2.315 . . . . 0.0 105.54 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -77.44 1.34 19.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.814 -1.179 . . . . 0.0 113.868 -173.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -129.94 -50.5 1.13 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.436 1.094 . . . . 0.0 111.116 -168.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 76.8 m -82.25 137.55 34.84 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.7 m -128.57 157.72 41.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.855 -1.906 . . . . 0.0 105.855 165.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -133.28 166.98 21.23 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 166.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.0 162.95 39.37 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -124.9 139.62 53.67 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.1 ttt -138.89 103.27 4.76 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -167.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.2 m -64.22 149.79 47.21 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.416 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.8 m-85 -55.13 -32.65 62.22 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -81.36 -11.66 83.05 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.573 -1.126 . . . . 0.0 113.426 -178.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.27 -42.96 82.98 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 120.169 1.984 . . . . 0.0 108.916 167.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -64.08 -45.4 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.13 1.372 . . . . 0.0 108.998 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 122.508 0.323 . . . . 0.0 111.531 -176.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.33 -40.64 97.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.718 0.771 . . . . 0.0 111.251 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtt-85 -65.9 -14.59 61.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 114.86 -1.063 . . . . 0.0 110.925 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.63 9.67 80.87 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 124.959 1.266 . . . . 0.0 112.762 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -83.61 -178.38 7.01 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 171.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -134.24 147.61 50.71 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -58.41 -31.1 67.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.431 -176.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -83.38 -47.14 11.76 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 173.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.05 -35.95 69.95 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.727 0.811 . . . . 0.0 112.522 -172.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -43.9 -55.82 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.465 1.106 . . . . 0.0 109.386 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -75.49 -16.26 60.32 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -172.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -116.92 7.7 13.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.748 0.819 . . . . 0.0 112.68 -166.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -136.51 88.9 2.41 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -48.95 -45.38 41.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -70.73 -30.79 67.41 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.617 -0.677 . . . . 0.0 111.007 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -78.42 -20.66 50.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.765 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.71 -49.3 71.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 167.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -53.49 -34.82 59.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.965 1.306 . . . . 0.0 112.68 -169.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -58.19 -33.96 69.84 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.719 1.208 . . . . 0.0 111.389 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -54.07 51.02 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -67.15 -36.59 82.17 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.029 0.932 . . . . 0.0 110.263 -173.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 m95 -57.37 -36.48 71.29 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.153 -0.927 . . . . 0.0 112.167 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -68.63 -42.48 77.98 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.464 1.484 . . . . 0.0 111.085 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.5 m -75.19 -38.33 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 120.935 -1.103 . . . . 0.0 111.477 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.8 mmt -59.98 -42.76 94.86 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.935 -0.555 . . . . 0.0 109.954 168.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.87 -41.25 82.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.045 0.839 . . . . 0.0 111.532 176.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -59.61 -9.34 2.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.373 1.869 . . . . 0.0 112.806 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -123.81 -8.33 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.25 1.82 . . . . 0.0 110.059 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -58.91 -28.08 65.86 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -163.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.38 -15.04 62.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.482 1.037 . . . . 0.0 112.462 177.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -112.3 -40.85 4.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.812 1.645 . . . . 0.0 109.236 174.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.73 -26.1 65.37 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.51 1.124 . . . . 0.0 112.118 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -57.5 -24.03 53.54 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.079 1.309 . . . . 0.0 112.569 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -78.83 -14.04 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.736 0.815 . . . . 0.0 112.09 176.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.21 8.57 2.47 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -164.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.16 69.1 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.936 1.35 . . . . 0.0 109.759 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -156.88 30.46 0.31 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.757 1.223 . . . . 0.0 110.088 -172.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 -179.88 37.84 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.373 0.987 . . . . 0.0 111.117 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.58 172.06 15.07 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.903 3.069 . . . . 0.0 112.317 -174.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 25.6 tp -135.93 154.32 51.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.404 1.482 . . . . 0.0 107.154 169.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -143.35 149.69 38.1 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.628 1.571 . . . . 0.0 107.256 -171.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mm -134.81 144.07 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.253 0.933 . . . . 0.0 109.728 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -138.57 150.54 46.43 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.638 1.975 . . . . 0.0 107.073 165.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.12 158.35 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.092 -1.005 . . . . 0.0 109.077 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.75 151.82 43.23 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 157.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.63 145.1 26.62 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 mp -124.27 -172.46 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.762 2.825 . . . . 0.0 107.714 -174.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.38 -37.84 84.87 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -167.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.7 mmtm -140.97 25.43 2.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.337 1.055 . . . . 0.0 112.569 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.76 -168.82 37.29 Favored Glycine 0 C--O 1.228 -0.255 0 O-C-N 120.98 -1.075 . . . . 0.0 110.551 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mp -135.01 145.34 47.99 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.729 1.211 . . . . 0.0 108.98 177.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -97.98 128.53 44.6 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 162.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.08 128.77 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.58 142.05 23.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 173.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.53 136.71 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 171.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.4 p -128.21 174.57 9.16 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.179 0.992 . . . . 0.0 110.113 -160.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -130.5 178.65 6.45 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.969 1.308 . . . . 0.0 110.173 170.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.45 8.78 2.56 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.154 1.381 . . . . 0.0 113.887 -175.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -60.12 143.53 52.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.937 0.895 . . . . 0.0 110.301 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.75 148.05 51.79 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 170.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -14.98 19.08 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.893 1.277 . . . . 0.0 114.366 -177.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -55.09 -32.85 62.3 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.754 -1.216 . . . . 0.0 111.102 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -71.2 7.43 1.28 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.068 1.347 . . . . 0.0 113.381 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.7 mt -135.3 -39.31 0.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.599 1.96 . . . . 0.0 109.177 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.16 -39.5 86.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.988 0.915 . . . . 0.0 112.097 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -64.77 141.1 58.89 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.411 0.55 . . . . 0.0 110.26 177.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.26 165.32 20.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.56 0.744 . . . . 0.0 109.517 173.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.1 m -135.58 160.92 65.93 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.32 1.448 . . . . 0.0 108.499 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.86 155.11 15.14 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.939 3.093 . . . . 0.0 113.195 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 . . . . . 0 C--O 1.252 1.212 0 CA-C-N 115.45 -0.795 . . . . 0.0 108.965 171.308 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptm . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 120.297 0.094 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -133.67 127.89 33.86 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 -170.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.1 mm -125.64 151.05 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.583 1.553 . . . . 0.0 107.957 -174.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -146.0 151.03 37.11 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.345 1.058 . . . . 0.0 110.885 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -112.4 101.98 10.14 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.333 1.853 . . . . 0.0 106.29 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.3 mm -70.17 -55.93 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -177.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -159.22 -170.5 3.01 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.141 1.376 . . . . 0.0 109.702 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.85 -15.74 5.35 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.206 1.403 . . . . 0.0 114.07 -175.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -124.72 -40.77 2.17 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.976 0.911 . . . . 0.0 111.468 -171.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -98.62 139.36 34.44 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 122.161 0.982 . . . . 0.0 109.305 -173.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -124.05 162.12 25.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 165.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.7 pttt -135.02 168.56 18.9 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.577 -0.702 . . . . 0.0 109.395 160.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.413 ' CE1' HG23 ' A' ' 44' ' ' VAL . 45.6 p90 -146.44 168.97 19.85 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -132.33 140.0 48.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -135.28 114.47 12.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -170.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -74.52 154.87 38.47 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.477 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-30 -53.98 -32.14 53.03 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 175.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -90.02 -8.05 67.39 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.257 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -47.65 69.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.973 1.886 . . . . 0.0 107.755 162.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.1 mt -56.85 -47.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.179 1.392 . . . . 0.0 108.546 176.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.96 -36.75 80.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 117.971 0.351 . . . . 0.0 111.74 -176.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -64.12 -41.17 97.34 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.58 0.705 . . . . 0.0 110.581 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.34 -4.02 23.84 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.771 1.228 . . . . 0.0 111.153 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.73 7.82 86.83 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.958 1.266 . . . . 0.0 112.634 173.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -84.18 -172.27 4.07 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 168.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -146.09 152.89 40.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -59.07 -33.27 70.6 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 120.168 1.349 . . . . 0.0 111.913 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.12 -48.14 21.77 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -63.16 -33.99 76.66 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 123.507 0.723 . . . . 0.0 112.51 -170.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.86 -56.74 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.036 0.934 . . . . 0.0 108.539 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -77.17 -33.85 56.46 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 121.849 -0.532 . . . . 0.0 111.57 -171.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -89.46 4.44 49.12 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.229 0.611 . . . . 0.0 111.866 -166.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -139.1 88.6 2.29 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -51.45 -38.94 56.21 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -30.57 59.2 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.586 -0.696 . . . . 0.0 111.189 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -80.56 -15.66 56.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.27 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -51.76 66.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 166.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -55.91 -31.13 62.59 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.546 1.538 . . . . 0.0 112.554 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.93 -38.66 76.32 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.897 1.279 . . . . 0.0 111.543 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -51.01 71.7 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.755 0.822 . . . . 0.0 109.223 176.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -65.24 -38.95 91.96 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.622 0.769 . . . . 0.0 110.41 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -60.46 -38.5 84.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 118.781 -0.628 . . . . 0.0 111.556 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -74.4 -33.98 63.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.708 1.14 . . . . 0.0 110.79 -174.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.413 HG23 ' CE1' ' A' ' 13' ' ' PHE . 17.8 m -72.67 -43.04 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 119.295 0.952 . . . . 0.0 111.635 175.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.0 mmt -55.05 -45.44 75.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.081 0.552 . . . . 0.0 109.61 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.38 -43.81 92.84 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.451 0.3 . . . . 0.0 111.697 176.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -63.95 -13.24 44.44 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.26 1.424 . . . . 0.0 112.491 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 m -120.84 3.18 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.339 1.056 . . . . 0.0 111.586 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -18.84 63.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -164.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.5 -23.47 65.93 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.351 0.978 . . . . 0.0 111.657 173.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -89.2 -8.13 54.21 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.447 1.099 . . . . 0.0 111.21 175.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -124.15 -18.8 5.77 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.418 1.087 . . . . 0.0 112.327 -162.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.68 -26.16 61.29 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.625 1.102 . . . . 0.0 112.179 177.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -83.73 -7.49 59.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.588 1.155 . . . . 0.0 112.651 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.3 7.92 2.0 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.561 1.144 . . . . 0.0 113.515 -166.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.263 7.6 p -79.04 71.1 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 123.077 1.418 . . . . 0.0 109.374 175.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -161.66 37.77 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.89 1.676 . . . . 0.0 108.972 -172.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.31 -173.56 22.69 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.919 1.247 . . . . 0.0 111.188 -173.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.44 179.58 4.96 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.518 2.812 . . . . 0.0 111.311 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.78 135.62 22.28 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -141.95 149.6 40.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.42 1.088 . . . . 0.0 109.084 -171.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.4 mm -132.59 145.91 33.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.896 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -138.71 92.29 2.61 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.412 1.485 . . . . 0.0 107.541 160.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.54 153.95 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.665 0.786 . . . . 0.0 108.884 166.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 152.13 34.07 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 152.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.38 143.36 32.78 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.672 0.789 . . . . 0.0 110.09 -175.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -130.12 -178.82 4.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.997 2.519 . . . . 0.0 107.914 -173.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.41 -35.04 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -164.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.1 mmtm -141.94 27.03 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.44 1.096 . . . . 0.0 112.353 178.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.89 -172.46 42.37 Favored Glycine 0 CA--C 1.519 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 110.801 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -136.72 139.45 41.92 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.515 1.126 . . . . 0.0 109.387 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -90.89 143.46 26.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 162.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.43 118.9 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.75 146.93 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 168.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.32 119.29 14.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 -174.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -121.02 165.16 15.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.637 0.653 . . . . 0.0 110.057 -163.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -152.17 167.12 29.58 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.76 1.624 . . . . 0.0 108.655 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.51 103.28 3.93 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -142.25 169.42 17.62 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.792 0.837 . . . . 0.0 110.24 -171.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.1 -29.72 67.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.302 1.041 . . . . 0.0 112.035 -175.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 m -61.99 1.57 0.28 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.685 1.594 . . . . 0.0 114.872 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.72 -30.25 13.38 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.795 0.838 . . . . 0.0 110.451 159.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -122.57 125.27 45.35 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 164.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.4 tp -150.98 -50.23 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.146 0.578 . . . . 0.0 110.31 -175.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -147.11 27.61 1.04 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 122.421 1.105 . . . . 0.0 111.182 -175.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.27 150.29 48.48 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.289 -176.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.35 158.87 30.57 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.423 0.689 . . . . 0.0 109.382 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.9 m -138.57 160.91 61.55 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 125.331 1.452 . . . . 0.0 108.626 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.06 155.71 14.55 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.246 3.297 . . . . 0.0 113.282 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 170.688 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 ptm . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -124.26 77.56 1.57 Allowed 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -158.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 mm -69.61 152.68 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.174 1.39 . . . . 0.0 110.422 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -140.19 149.95 43.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.069 1.747 . . . . 0.0 109.674 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -109.24 107.62 17.93 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.0 mm -73.64 -55.53 12.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.1 p30 -163.34 -175.76 4.42 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.297 1.839 . . . . 0.0 107.373 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.3 -24.32 59.18 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.381 -1.45 . . . . 0.0 113.04 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -102.3 -25.75 13.55 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.944 0.897 . . . . 0.0 111.851 -169.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 75.6 m -128.04 137.07 52.04 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.247 1.022 . . . . 0.0 108.523 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 m -123.44 156.59 29.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 105.505 -2.035 . . . . 0.0 105.505 166.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 pttt -135.51 168.93 18.33 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 161.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -153.71 161.1 42.42 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -110.67 143.98 40.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 166.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -139.45 108.81 6.13 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 152.37 45.48 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.6 m-85 -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.02 0.528 . . . . 0.0 112.221 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.19 -25.44 69.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.058 -0.857 . . . . 0.0 113.402 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.82 -38.94 80.22 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.301 1.551 . . . . 0.0 109.64 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.2 mt -71.37 -42.27 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 125.016 1.326 . . . . 0.0 108.319 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.27 -39.55 90.8 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.787 1.235 . . . . 0.0 111.458 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -62.96 -42.1 99.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.624 0.726 . . . . 0.0 111.132 -177.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.8 mtt-85 -68.43 -11.52 59.82 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.221 173.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.55 12.34 84.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.613 1.102 . . . . 0.0 113.243 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -82.73 -175.07 5.6 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 167.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -137.2 152.83 50.32 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 170.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.8 ptt-85 -59.04 -27.69 65.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.797 1.239 . . . . 0.0 113.259 -175.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -91.52 -43.75 9.49 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.65 -34.16 70.9 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 124.245 1.018 . . . . 0.0 112.314 -174.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -44.17 -56.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 124.474 1.11 . . . . 0.0 109.128 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -74.62 -34.44 62.8 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.118 0.567 . . . . 0.0 112.06 -172.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -94.14 7.68 44.35 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -168.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -134.73 89.94 2.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -52.38 -37.42 56.29 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -164.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -32.43 58.92 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.775 0.43 . . . . 0.0 111.704 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -76.66 -20.05 57.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.898 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.3 -50.84 70.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 168.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -35.01 62.21 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.92 1.288 . . . . 0.0 112.781 -169.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -58.12 -34.92 70.75 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.371 1.068 . . . . 0.0 111.193 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -54.8 42.62 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.074 0.95 . . . . 0.0 108.707 174.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -64.85 -38.1 89.85 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.115 0.966 . . . . 0.0 110.181 -174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -60.74 -37.8 83.0 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.344 -0.836 . . . . 0.0 112.584 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.54 -38.39 80.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 120.363 1.438 . . . . 0.0 111.513 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.9 m -74.04 -42.01 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 121.008 -1.057 . . . . 0.0 111.677 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.04 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.856 0.462 . . . . 0.0 109.959 168.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.19 -38.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 118.06 0.391 . . . . 0.0 111.788 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.16 -13.14 15.69 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.653 1.181 . . . . 0.0 112.993 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.96 16.05 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 124.98 1.312 . . . . 0.0 111.691 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -23.99 67.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.409 -0.807 . . . . 0.0 112.328 -169.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.53 -25.82 67.54 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -91.45 -44.92 8.83 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.54 0.736 . . . . 0.0 109.261 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -64.97 -26.78 68.44 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 118.314 -0.851 . . . . 0.0 112.187 -172.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -61.31 -9.85 5.96 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 120.338 1.426 . . . . 0.0 112.785 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.68 -0.77 11.74 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.578 1.551 . . . . 0.0 111.9 173.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.97 3.87 1.25 Allowed 'General case' 0 C--N 1.342 0.254 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -166.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.267 7.9 p -81.32 57.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 120.254 1.388 . . . . 0.0 109.664 173.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -83.6 12.59 5.54 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.47 1.108 . . . . 0.0 112.361 -166.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.95 177.34 42.79 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.65 1.119 . . . . 0.0 110.635 -177.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.42 167.53 26.08 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.001 3.134 . . . . 0.0 111.017 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.91 147.98 49.56 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.42 0.629 . . . . 0.0 109.433 171.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -147.79 142.43 26.59 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 128.286 2.634 . . . . 0.0 104.296 173.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -144.15 152.55 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 120.309 1.413 . . . . 0.0 110.742 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -137.83 148.93 45.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.384 1.874 . . . . 0.0 106.697 170.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 p -141.42 160.2 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 O-C-N 120.46 -1.4 . . . . 0.0 109.459 -176.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -142.72 152.19 42.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 158.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.46 141.68 34.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -124.58 -174.84 3.12 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.927 2.491 . . . . 0.0 107.831 -172.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.29 -37.93 82.05 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -166.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 75.1 mmtt -140.45 25.67 2.2 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.339 1.056 . . . . 0.0 111.673 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.53 -170.4 39.08 Favored Glycine 0 C--O 1.227 -0.321 0 O-C-N 121.101 -1.0 . . . . 0.0 110.972 -174.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.16 146.27 44.75 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.803 1.241 . . . . 0.0 108.848 177.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -97.47 129.42 44.66 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 161.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -117.57 128.46 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 105.183 -2.154 . . . . 0.0 105.183 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -103.56 145.16 13.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 169.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.03 134.87 42.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.5 p -134.02 175.9 9.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.677 0.791 . . . . 0.0 109.82 -164.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.8 mppt? -138.42 171.88 13.72 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.517 1.527 . . . . 0.0 108.644 171.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 178.79 0.23 Allowed 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.778 1.231 . . . . 0.0 111.371 174.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 55.88 45.29 24.38 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.943 1.297 . . . . 0.0 110.123 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 39.33 1.48 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.441 1.896 . . . . 0.0 106.894 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 m -134.68 20.51 3.57 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.283 -146.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.48 -34.23 66.73 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.308 0.643 . . . . 0.0 110.646 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -139.07 125.48 20.4 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 163.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.0 tp -130.55 -28.28 2.07 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.903 1.281 . . . . 0.0 110.378 -170.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -63.89 -21.46 66.47 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.317 0.647 . . . . 0.0 111.709 165.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.256 69.9 mmtt 52.7 54.0 11.27 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.025 1.73 . . . . 0.0 110.139 -166.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.7 pp -56.98 160.04 3.8 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.26 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.87 160.23 65.47 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 108.732 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.27 156.77 12.74 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.148 3.232 . . . . 0.0 113.193 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 65.5 mtp85 . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.926 1.69 . . . . 0.0 107.85 177.061 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -139.78 78.72 1.68 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -145.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 mm -67.6 153.69 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 124.142 0.977 . . . . 0.0 109.404 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.92 152.65 42.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.731 1.613 . . . . 0.0 110.303 172.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.5 tpp85 -114.69 90.95 3.46 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.912 1.685 . . . . 0.0 106.758 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.42 -53.23 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 122.023 0.916 . . . . 0.0 109.019 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -151.45 -168.76 3.18 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.597 2.359 . . . . 0.0 105.558 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -77.84 5.18 10.1 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.084 -1.01 . . . . 0.0 113.69 -172.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -130.68 -55.14 1.07 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.289 1.036 . . . . 0.0 110.682 -171.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -77.38 138.6 39.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 171.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -125.36 160.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 166.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.2 pttt -134.29 168.95 17.95 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 160.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.0 142.42 25.23 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 170.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -94.05 137.94 32.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 165.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.4 ttt -131.24 116.71 18.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -174.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -76.27 154.06 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -56.66 -39.06 73.08 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.524 -0.735 . . . . 0.0 112.209 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.54 -24.61 73.88 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.763 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -28.63 64.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.083 1.442 . . . . 0.0 110.627 174.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.54 -43.45 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.825 1.25 . . . . 0.0 107.661 178.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.17 -39.58 82.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.565 1.146 . . . . 0.0 111.327 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.13 -45.25 92.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.247 1.019 . . . . 0.0 111.276 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.7 mtt85 -69.03 -6.89 30.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.341 1.056 . . . . 0.0 111.527 172.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.65 12.91 84.03 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.547 1.07 . . . . 0.0 113.194 176.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.69 -174.06 4.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 167.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -139.05 149.69 44.9 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.1 ptt180 -62.38 -31.4 72.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -168.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.54 -44.1 12.95 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 173.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.62 -35.92 68.85 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.309 1.044 . . . . 0.0 112.69 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.1 mm -43.51 -50.98 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 124.791 1.236 . . . . 0.0 110.683 169.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.4 m95 -80.22 -12.95 59.58 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.259 1.024 . . . . 0.0 113.55 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -123.03 7.28 9.24 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -166.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -124.98 99.41 6.12 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 172.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 46.2 ptt85 -60.27 -14.29 17.26 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -163.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -30.37 7.32 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.563 1.545 . . . . 0.0 111.891 178.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -79.53 -14.96 58.51 Favored 'General case' 0 C--N 1.339 0.151 0 O-C-N 121.3 -0.875 . . . . 0.0 111.322 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.5 p -52.19 -57.5 9.45 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.171 0.989 . . . . 0.0 109.533 163.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.48 -32.06 64.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.232 1.813 . . . . 0.0 112.522 -167.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -60.01 -34.8 73.84 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.661 1.185 . . . . 0.0 111.219 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -51.94 67.76 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 174.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -66.18 -38.43 88.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.429 0.691 . . . . 0.0 109.924 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -58.34 -37.55 75.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.627 -0.702 . . . . 0.0 112.097 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -64.39 -39.68 94.32 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.022 1.283 . . . . 0.0 111.134 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.8 m -82.47 -39.39 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 O-C-N 121.086 -1.009 . . . . 0.0 112.33 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 mmt -53.14 -47.07 69.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.408 0.683 . . . . 0.0 109.422 166.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.84 -42.0 78.89 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.575 0.625 . . . . 0.0 111.84 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -59.73 -14.86 16.15 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.082 1.353 . . . . 0.0 113.08 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 m -129.76 2.75 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 C-N-CA 124.396 1.078 . . . . 0.0 111.976 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -24.32 67.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -162.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.82 -15.94 35.54 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.66 0.664 . . . . 0.0 112.115 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -113.38 3.14 15.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.868 1.667 . . . . 0.0 110.957 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -115.18 -21.34 10.0 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.228 1.411 . . . . 0.0 111.346 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.31 -15.84 18.38 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -176.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -112.67 6.48 18.26 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.003 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -136.37 0.92 2.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.157 1.383 . . . . 0.0 113.217 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -78.29 73.17 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 122.947 1.356 . . . . 0.0 109.415 172.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -153.64 32.42 0.45 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.012 1.325 . . . . 0.0 109.555 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.13 -178.16 35.78 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.084 1.326 . . . . 0.0 110.84 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -71.91 171.15 17.19 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.7 2.933 . . . . 0.0 112.197 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.93 152.08 46.08 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.588 1.555 . . . . 0.0 107.121 171.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -144.11 150.51 38.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.96 1.304 . . . . 0.0 107.683 -168.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mm -135.0 144.72 33.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -172.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.63 170.59 15.56 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 148.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.27 159.6 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.513 -0.742 . . . . 0.0 110.702 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -129.18 145.37 51.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.751 2.42 . . . . 0.0 105.409 167.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.42 132.0 54.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 168.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.14 -169.81 1.86 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.415 2.286 . . . . 0.0 108.496 -170.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.87 -41.84 98.34 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -169.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -140.11 22.9 2.41 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.697 1.199 . . . . 0.0 112.445 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.19 -168.44 36.38 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mp -135.62 146.77 48.23 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.462 1.505 . . . . 0.0 108.725 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -100.83 122.67 43.81 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 164.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.73 127.25 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -109.93 142.1 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.17 115.14 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -170.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -117.24 171.04 8.22 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.582 0.628 . . . . 0.0 110.435 -163.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -134.73 175.99 9.05 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.237 1.415 . . . . 0.0 109.768 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.64 154.59 28.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.146 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -61.73 140.01 58.25 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 49.2 tp -145.74 130.55 18.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -69.16 -3.85 15.13 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -166.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -56.28 -41.99 76.75 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.176 1.353 . . . . 0.0 109.832 169.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.03 34.63 0.41 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.203 1.001 . . . . 0.0 111.321 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 tt -145.51 -47.52 0.22 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.686 1.995 . . . . 0.0 106.821 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.07 -44.87 95.75 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.215 1.006 . . . . 0.0 111.43 172.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -72.73 138.72 46.73 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -149.33 171.18 16.95 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.264 1.426 . . . . 0.0 110.749 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.69 160.22 68.44 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 124.719 1.208 . . . . 0.0 108.811 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -55.58 159.36 11.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.1 3.2 . . . . 0.0 113.049 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 . . . . . 0 C--O 1.255 1.363 0 C-N-CA 125.891 1.677 . . . . 0.0 107.837 175.361 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.977 0.418 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -127.49 74.97 1.56 Allowed 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 -149.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 mm -69.29 152.56 9.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.106 1.362 . . . . 0.0 110.167 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.64 152.42 45.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.437 1.895 . . . . 0.0 109.869 172.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.9 tpp85 -118.29 91.61 3.61 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.178 1.791 . . . . 0.0 106.185 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.33 -53.38 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.4 p30 -156.92 -166.88 2.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.787 2.035 . . . . 0.0 106.54 175.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.17 2.58 23.68 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.748 -1.22 . . . . 0.0 113.886 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -129.66 -29.2 2.18 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.164 1.386 . . . . 0.0 111.894 -169.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 62.9 m -111.53 133.07 54.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.526 1.53 . . . . 0.0 107.849 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.7 m -122.65 159.25 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 165.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -139.26 172.19 13.18 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 161.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 35.9 p90 -150.49 169.81 20.6 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 169.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -122.5 144.23 49.21 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 167.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -137.48 114.89 11.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 -173.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.24 158.08 35.87 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.517 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.3 m-30 -53.01 -39.07 62.87 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.549 -0.72 . . . . 0.0 111.982 172.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.31 -25.74 73.58 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.451 -0.638 . . . . 0.0 113.051 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -34.53 76.55 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.979 1.389 . . . . 0.0 110.027 173.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 32.4 mt -76.88 -43.1 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.843 1.257 . . . . 0.0 107.907 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.83 -40.77 80.84 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.075 1.35 . . . . 0.0 111.397 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.31 -43.37 98.99 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.594 0.758 . . . . 0.0 111.312 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.1 mtt85 -70.85 -7.55 46.29 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.46 174.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 13.0 84.08 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.695 1.141 . . . . 0.0 112.952 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -82.41 -175.02 5.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.402 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.3 t70 -140.1 147.43 40.24 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -54.76 -38.06 66.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.232 0.924 . . . . 0.0 111.04 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -75.6 -45.0 40.09 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.402 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.6 mm-40 -61.1 -38.22 85.54 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.319 -0.863 . . . . 0.0 111.331 -173.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -54.95 -45.49 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 123.796 0.839 . . . . 0.0 109.773 171.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -69.03 -22.68 64.03 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.488 1.04 . . . . 0.0 112.974 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -120.46 3.93 10.73 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -161.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -137.79 82.4 1.92 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -47.7 -42.3 24.63 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -166.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -31.59 63.99 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.66 -0.65 . . . . 0.0 111.417 -178.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.57 -20.41 54.09 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.96 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -52.08 64.66 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 166.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.8 -32.33 60.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.303 1.441 . . . . 0.0 113.092 -168.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.92 -37.63 69.18 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.539 1.136 . . . . 0.0 111.671 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.32 -50.08 74.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.493 0.717 . . . . 0.0 109.689 177.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -65.16 -38.41 90.47 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.531 0.732 . . . . 0.0 109.573 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -59.87 -34.88 73.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.095 171.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.8 -40.49 69.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 120.622 1.556 . . . . 0.0 110.529 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.4 m -70.88 -41.26 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.258 -0.901 . . . . 0.0 110.927 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.2 mmt -57.95 -42.67 85.43 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.113 0.565 . . . . 0.0 110.49 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.0 -41.3 97.9 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.757 0.708 . . . . 0.0 111.779 176.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -63.37 -13.19 36.69 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.636 1.574 . . . . 0.0 111.864 174.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.5 t -109.66 -5.08 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.983 1.713 . . . . 0.0 109.655 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -56.43 -31.08 63.59 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -161.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.52 -14.67 58.52 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.225 0.92 . . . . 0.0 112.94 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -114.26 -36.9 4.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.99 1.716 . . . . 0.0 109.923 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.87 -28.02 65.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.699 1.199 . . . . 0.0 111.521 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.21 -24.93 57.86 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.405 1.002 . . . . 0.0 112.609 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -83.14 -9.89 58.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.073 0.949 . . . . 0.0 111.983 177.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -135.49 8.64 3.37 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 0.0 113.149 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.6 p -84.68 61.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 123.269 1.509 . . . . 0.0 109.15 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -156.08 31.69 0.34 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.676 1.19 . . . . 0.0 109.457 -171.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -173.87 -177.35 43.01 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.996 1.76 . . . . 0.0 109.328 -172.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.23 173.29 11.61 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.466 2.778 . . . . 0.0 112.116 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.3 tp -138.23 150.06 46.36 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 170.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -142.98 149.73 38.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.547 1.139 . . . . 0.0 107.974 -170.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mm -134.31 144.76 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -171.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -142.9 151.62 41.21 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 162.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.7 p -145.22 158.63 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.455 -1.403 . . . . 0.0 109.821 -166.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -136.32 152.21 50.43 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.58 133.18 49.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 158.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -123.51 178.26 5.26 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.544 1.938 . . . . 0.0 108.099 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.13 -31.85 70.46 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -165.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.517 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.5 mmtm -140.68 21.81 2.33 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.426 1.09 . . . . 0.0 112.656 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.29 -168.27 36.83 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 120.841 -1.162 . . . . 0.0 111.637 -174.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.7 mp -133.08 138.98 46.91 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.285 1.834 . . . . 0.0 107.4 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -94.6 143.95 26.0 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 157.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.6 mt -141.62 121.66 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -107.37 142.6 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.53 129.09 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -134.23 168.5 18.75 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.923 0.783 . . . . 0.0 111.26 -163.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -136.37 168.43 19.46 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 126.047 1.739 . . . . 0.0 109.787 168.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.68 137.08 58.22 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 114.296 -1.32 . . . . 0.0 107.925 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -158.6 159.37 35.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.936 1.295 . . . . 0.0 108.749 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.6 tp -144.2 56.31 1.31 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.203 1.001 . . . . 0.0 108.53 -173.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 m -71.11 35.39 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.735 2.014 . . . . 0.0 113.433 -175.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -64.83 -42.84 94.62 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 120.878 -1.139 . . . . 0.0 109.458 174.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.61 106.69 7.29 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 167.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.5 tp -158.25 -40.68 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -68.85 -27.59 65.95 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -175.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -61.99 147.36 47.3 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 110.826 -177.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.4 158.77 28.47 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.363 0.665 . . . . 0.0 109.529 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.7 m -138.12 161.47 59.35 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 125.259 1.424 . . . . 0.0 108.464 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -53.78 156.35 12.22 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 124.086 3.191 . . . . 0.0 113.348 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.954 1.702 . . . . 0.0 108.073 177.457 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptm . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 110.851 -0.055 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -132.26 127.88 36.66 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -168.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.8 mm -123.77 151.15 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 125.083 1.353 . . . . 0.0 107.976 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -148.31 130.03 15.08 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.595 0.758 . . . . 0.0 110.827 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -88.45 110.78 21.11 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mm -74.47 -58.16 5.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.239 0 N-CA-C 108.488 -0.931 . . . . 0.0 108.488 178.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -157.62 -173.98 4.65 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.605 1.562 . . . . 0.0 108.787 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -56.38 -14.81 3.23 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -174.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -121.09 -46.69 2.31 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.795 1.238 . . . . 0.0 110.879 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.1 m -94.7 142.3 27.61 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.93 0.872 . . . . 0.0 109.621 -172.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.8 m -126.13 163.72 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 166.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.2 pttt -134.04 169.13 17.59 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.496 -0.752 . . . . 0.0 109.243 160.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -147.07 167.09 24.96 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 123.831 0.853 . . . . 0.0 108.699 172.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -132.97 143.58 49.55 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 170.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.3 ttt -141.8 112.02 6.93 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -168.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.91 156.06 40.06 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 175.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.468 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -55.33 -40.5 71.26 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.389 -0.819 . . . . 0.0 111.978 176.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.86 -12.98 84.08 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 118.612 -1.105 . . . . 0.0 113.769 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.02 -33.74 76.49 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.858 1.829 . . . . 0.0 109.282 166.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.5 mt -77.81 -40.9 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.96 -37.16 81.43 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.207 0.458 . . . . 0.0 111.584 175.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -64.5 -42.43 95.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.87 0.843 . . . . 0.0 111.182 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.6 mtt85 -70.1 -8.02 46.14 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.37 -1.286 . . . . 0.0 111.386 173.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.09 12.81 84.29 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.492 1.044 . . . . 0.0 112.988 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -83.6 -171.87 3.83 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 165.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -139.61 148.17 42.11 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.5 ptt85 -57.96 -31.05 66.49 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 118.77 -0.633 . . . . 0.0 112.064 -177.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -83.1 -46.07 13.23 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.35 -36.46 68.81 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.811 0.844 . . . . 0.0 112.472 -173.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mm -46.03 -48.97 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.508 1.123 . . . . 0.0 110.342 171.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -80.45 -13.35 59.19 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.939 1.088 . . . . 0.0 113.939 -175.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -122.01 10.87 10.19 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.046 0.839 . . . . 0.0 112.731 -166.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -133.63 99.26 4.43 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -58.75 -15.61 12.91 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -164.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.4 -30.83 7.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.463 1.505 . . . . 0.0 111.708 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -78.5 -15.7 58.31 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 118.923 0.783 . . . . 0.0 111.597 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 p -53.56 -60.69 2.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.036 0.935 . . . . 0.0 109.477 164.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -58.46 -29.15 65.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.854 1.662 . . . . 0.0 112.454 -165.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.12 -38.15 73.04 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.728 1.211 . . . . 0.0 111.394 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.2 -55.59 32.96 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -63.02 -35.98 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.565 1.146 . . . . 0.0 110.635 -175.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.7 m95 -63.8 -38.4 90.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.686 -1.149 . . . . 0.0 112.018 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -68.62 -45.54 71.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.737 1.608 . . . . 0.0 109.868 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.6 -45.97 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 O-C-N 121.489 -0.757 . . . . 0.0 110.581 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.5 tpp -61.85 -37.05 83.04 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.868 -0.52 . . . . 0.0 109.946 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -64.92 -41.86 95.19 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.074 0.852 . . . . 0.0 111.511 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.96 -41.48 98.04 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.549 1.14 . . . . 0.0 110.186 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.7 t -73.5 -16.87 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.685 1.194 . . . . 0.0 111.174 176.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -58.15 -26.31 62.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.68 1.582 . . . . 0.0 115.22 -157.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -58.9 -22.71 60.01 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.608 1.095 . . . . 0.0 112.122 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -95.16 -2.14 50.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.326 1.45 . . . . 0.0 111.615 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -134.09 -16.73 2.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.361 1.065 . . . . 0.0 112.567 -161.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.82 -17.43 36.07 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.447 1.099 . . . . 0.0 113.44 -178.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -107.17 3.69 25.96 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.703 1.601 . . . . 0.0 111.684 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.54 18.75 2.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.43 1.492 . . . . 0.0 112.14 -175.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.3 p -92.07 73.26 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.856 1.312 . . . . 0.0 107.694 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -152.96 31.78 0.49 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.004 -172.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.72 -179.22 37.16 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.061 1.315 . . . . 0.0 110.467 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -71.83 170.32 19.06 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.521 2.814 . . . . 0.0 112.001 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 49.1 mt -135.45 155.53 50.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.501 1.52 . . . . 0.0 107.731 171.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -150.62 147.22 27.14 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.441 1.497 . . . . 0.0 107.201 -162.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 8.4 mm -131.81 141.27 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -136.73 88.89 2.4 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.706 1.602 . . . . 0.0 106.798 167.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.21 154.41 8.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 166.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.66 152.3 33.78 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 152.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.0 143.36 33.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 109.617 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -129.51 -175.83 3.71 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 127.947 2.499 . . . . 0.0 107.898 -171.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.0 -38.25 82.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -164.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.8 mmtm -142.3 28.15 1.69 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.557 1.143 . . . . 0.0 111.746 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.13 -172.61 41.04 Favored Glycine 0 CA--C 1.517 0.165 0 O-C-N 121.14 -0.975 . . . . 0.0 110.876 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.58 139.77 44.12 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 124.392 1.077 . . . . 0.0 109.447 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -90.79 145.74 24.54 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 161.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.0 mt -134.97 122.59 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 106.789 -1.559 . . . . 0.0 106.789 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -93.99 146.57 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 169.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.7 118.24 11.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 -171.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -124.55 173.87 8.19 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.81 0.732 . . . . 0.0 111.44 -159.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -135.9 173.69 11.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.179 1.392 . . . . 0.0 109.972 165.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.42 148.82 51.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.4 164.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -134.4 34.27 3.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.517 1.127 . . . . 0.0 109.457 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp 48.02 44.55 18.89 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.582 1.553 . . . . 0.0 109.559 -166.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -69.45 -8.61 48.36 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -154.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -56.11 -37.67 69.74 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.767 -1.208 . . . . 0.0 110.1 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -72.95 4.04 4.66 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.874 1.27 . . . . 0.0 112.943 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.7 mt -121.88 -35.55 3.17 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.954 1.702 . . . . 0.0 109.564 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -67.01 -43.11 83.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.717 0.807 . . . . 0.0 110.522 168.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -76.72 156.92 32.12 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-O 121.023 0.44 . . . . 0.0 109.912 170.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.8 tp -149.91 157.55 43.29 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.902 0.881 . . . . 0.0 109.713 -167.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.6 m -138.15 161.56 58.78 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.014 1.326 . . . . 0.0 108.683 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.92 157.14 13.66 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.087 3.191 . . . . 0.0 113.235 175.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.243 0 C-N-CA 124.008 0.923 . . . . 0.0 108.666 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.551 0.204 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -135.62 130.88 35.07 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 125.418 1.487 . . . . 0.0 106.998 -170.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.8 mm -122.39 152.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.51 1.524 . . . . 0.0 108.646 -173.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -143.92 149.29 36.63 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.21 1.404 . . . . 0.0 110.617 169.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -112.5 102.4 10.51 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.7 mm -70.98 -55.3 14.53 Favored 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.2 p30 -163.03 -170.39 2.31 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.99 1.716 . . . . 0.0 107.863 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.19 -20.05 63.77 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.729 -1.232 . . . . 0.0 112.509 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -108.25 -30.4 8.38 Favored 'General case' 0 CA--C 1.522 -0.103 0 O-C-N 121.136 -0.977 . . . . 0.0 111.606 -163.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.6 m -123.1 138.72 54.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.788 1.235 . . . . 0.0 108.755 -178.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -125.92 157.25 35.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 162.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -135.38 167.45 21.02 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 166.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.455 ' CE1' HG21 ' A' ' 44' ' ' VAL . 55.2 p90 -152.68 167.95 27.27 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -130.31 137.07 49.76 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 tpt -132.88 106.76 7.9 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -168.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -68.4 156.29 38.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 175.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.456 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.6 m-85 -55.66 -37.02 67.73 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.487 -0.758 . . . . 0.0 111.425 173.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.05 -32.33 83.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.371 -0.683 . . . . 0.0 112.723 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -40.17 85.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.173 1.486 . . . . 0.0 110.05 177.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 31.6 mt -67.0 -49.28 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.827 1.251 . . . . 0.0 109.116 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -59.63 -38.18 80.65 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 126.042 1.737 . . . . 0.0 111.293 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.76 -40.2 91.82 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.034 0.921 . . . . 0.0 110.521 -175.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -70.57 -7.95 47.85 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.282 -1.326 . . . . 0.0 111.611 173.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.42 10.31 84.72 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.926 1.25 . . . . 0.0 113.234 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -84.04 -178.5 6.99 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 168.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.47 151.14 45.96 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.024 -1.047 . . . . 0.0 108.562 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -62.95 -31.22 72.27 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -166.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.54 -42.37 13.58 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -60.53 -34.82 74.67 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 123.729 0.812 . . . . 0.0 112.175 -172.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.4 mm -41.75 -57.26 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.418 1.087 . . . . 0.0 109.137 167.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -73.17 -38.68 66.1 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.821 0.449 . . . . 0.0 111.664 -173.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -89.34 4.14 49.88 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -169.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -130.74 84.31 2.18 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -51.6 -41.87 61.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.394 -0.816 . . . . 0.0 112.687 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -28.48 66.71 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.49 -0.756 . . . . 0.0 111.712 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -81.61 -18.45 44.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.417 -0.802 . . . . 0.0 111.299 175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.33 -46.69 85.47 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 163.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.516 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 8.6 tt0 -53.89 -32.91 54.96 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.213 1.005 . . . . 0.0 113.415 -171.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.25 -32.71 73.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.422 1.489 . . . . 0.0 111.028 -176.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -47.34 85.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.516 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 1.4 m-30 -68.97 -43.31 75.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.295 1.038 . . . . 0.0 109.521 -173.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -54.91 -39.47 68.83 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.471 -0.776 . . . . 0.0 111.533 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.8 -39.2 90.7 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.557 1.071 . . . . 0.0 111.333 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.455 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.5 m -78.39 -39.19 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.002 -1.061 . . . . 0.0 112.02 -174.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.5 mmm -55.32 -48.11 74.63 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.3 -38.23 79.72 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.39 -16.57 9.48 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.439 1.495 . . . . 0.0 112.733 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 m -135.87 12.01 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 125.386 1.474 . . . . 0.0 111.117 -173.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -21.45 62.59 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -160.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -58.71 -28.34 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.996 0.918 . . . . 0.0 111.254 174.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -90.63 3.15 54.94 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.363 1.465 . . . . 0.0 111.327 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -134.31 -24.81 1.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 O-C-N 121.237 -0.914 . . . . 0.0 112.822 -161.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -57.28 -22.93 45.02 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.106 0.963 . . . . 0.0 113.134 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -95.53 4.52 53.11 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.115 1.366 . . . . 0.0 112.359 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.25 -24.46 2.07 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.444 1.098 . . . . 0.0 113.153 -175.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -73.43 1.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 120.142 1.337 . . . . 0.0 113.336 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -56.7 -18.53 12.69 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.123 1.369 . . . . 0.0 113.366 156.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.57 -173.44 23.04 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.433 1.492 . . . . 0.0 111.911 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.46 171.69 12.57 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.421 2.747 . . . . 0.0 111.832 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.98 152.1 48.58 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.346 1.459 . . . . 0.0 107.442 175.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -147.85 145.04 28.55 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 125.598 1.559 . . . . 0.0 107.615 -164.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -133.79 141.28 44.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -138.24 159.39 42.17 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.77 2.028 . . . . 0.0 107.27 167.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.87 162.53 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 120.553 -1.342 . . . . 0.0 110.968 -170.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.36 149.01 52.44 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 126.862 2.065 . . . . 0.0 106.041 160.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.07 129.59 55.47 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 167.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 mp -118.9 -175.3 2.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 108.319 -170.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.28 -35.52 80.61 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -166.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.456 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.5 mmtm -141.42 23.93 2.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.346 1.059 . . . . 0.0 112.124 -178.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.05 -171.4 40.58 Favored Glycine 0 N--CA 1.454 -0.138 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mp -136.77 143.08 43.04 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.432 1.093 . . . . 0.0 108.341 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -90.25 141.46 28.69 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 161.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.427 ' HB ' ' CZ ' ' A' ' 13' ' ' PHE . 0.7 OUTLIER -127.98 132.36 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 175.197 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -112.5 139.05 39.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 104.406 -2.442 . . . . 0.0 104.406 177.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.26 142.22 41.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 119.302 0.955 . . . . 0.0 109.935 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -136.86 170.86 15.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.411 0.684 . . . . 0.0 110.193 -159.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -137.66 154.63 49.67 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.862 1.265 . . . . 0.0 108.9 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.75 -25.57 66.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -168.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -64.97 -32.7 74.54 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.217 -178.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 34.07 46.89 0.17 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.938 2.495 . . . . 0.0 114.736 168.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.6 m 55.85 20.49 4.16 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.923 1.689 . . . . 0.0 114.75 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -59.83 -44.49 94.03 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 120.934 -1.104 . . . . 0.0 108.376 167.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -77.09 34.24 0.15 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.737 1.615 . . . . 0.0 111.619 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt -143.74 -46.19 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.519 1.927 . . . . 0.0 107.07 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.69 -45.77 92.92 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 169.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -74.35 135.55 42.48 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 165.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.1 159.18 31.44 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.908 0.883 . . . . 0.0 110.057 -178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.9 m -136.73 158.57 72.84 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 125.16 1.384 . . . . 0.0 108.652 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.23 164.51 30.99 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.742 2.294 . . . . 0.0 111.194 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 57.3 mtm180 . . . . . 0 C--O 1.253 1.244 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 171.015 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.498 1.963 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -130.2 127.06 38.9 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -170.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 mm -121.55 150.43 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.876 1.27 . . . . 0.0 108.861 -170.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -146.45 150.4 35.55 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.047 1.339 . . . . 0.0 109.923 172.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.17 99.83 6.27 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -179.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -71.1 -56.09 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -168.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.0 p30 -156.27 -168.09 2.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.476 1.51 . . . . 0.0 108.376 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.4 -17.1 58.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -117.3 -53.65 2.43 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.166 -0.959 . . . . 0.0 109.671 -167.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 44.9 m -86.55 138.06 32.02 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.81 0.844 . . . . 0.0 109.48 177.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.5 m -131.65 158.98 43.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 165.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -144.32 170.38 16.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.933 -1.105 . . . . 0.0 109.975 170.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.42 ' CE1' HG22 ' A' ' 44' ' ' VAL . 53.7 p90 -151.93 167.76 27.33 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -128.92 141.08 51.39 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 173.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.4 ttt -140.8 105.67 4.95 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -167.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.1 m -65.79 149.86 49.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.421 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.2 m-85 -55.88 -32.89 64.1 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.5 -7.58 81.98 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 118.572 -1.126 . . . . 0.0 113.362 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -66.87 -49.04 66.92 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.26 2.03 . . . . 0.0 107.958 164.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.36 -46.43 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.197 1.399 . . . . 0.0 108.855 177.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.71 -36.29 80.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.328 0.251 . . . . 0.0 111.397 -176.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.39 -40.69 85.69 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.493 0.717 . . . . 0.0 111.027 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.7 mtp85 -64.07 -14.97 58.4 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.988 -1.005 . . . . 0.0 111.703 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.05 7.19 80.94 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.33 -0.705 . . . . 0.0 113.18 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -80.45 -174.88 4.87 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 166.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -138.79 148.4 43.77 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -59.08 -30.68 68.25 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.595 0.634 . . . . 0.0 112.469 -174.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -82.69 -48.78 10.5 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.33 -36.61 66.44 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.989 0.916 . . . . 0.0 112.919 -171.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -44.29 -54.76 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 124.391 1.076 . . . . 0.0 109.354 170.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -76.95 -11.96 59.88 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -121.76 7.24 9.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.695 0.798 . . . . 0.0 112.84 -167.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -136.66 87.04 2.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.473 -2.047 . . . . 0.0 105.473 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -51.12 -38.14 50.13 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -164.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.28 -32.13 58.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.614 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -79.53 -18.1 52.6 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.286 176.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -48.99 75.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 166.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -53.27 -34.74 58.49 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.292 1.437 . . . . 0.0 112.696 -169.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -59.26 -32.98 70.5 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.377 1.471 . . . . 0.0 111.315 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -57.84 11.09 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.418 1.087 . . . . 0.0 108.328 173.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -63.98 -36.73 84.94 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.848 1.259 . . . . 0.0 110.918 -172.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -56.11 -44.23 78.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.778 172.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.23 -41.54 76.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.498 1.045 . . . . 0.0 111.279 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.42 HG22 ' CE1' ' A' ' 13' ' ' PHE . 17.6 m -70.96 -43.21 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 121.217 -0.927 . . . . 0.0 111.389 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 50.5 tpp -56.8 -43.28 80.78 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 123.621 0.768 . . . . 0.0 109.056 172.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.55 -40.26 94.05 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.457 -0.777 . . . . 0.0 111.925 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.72 -9.45 9.25 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.604 1.561 . . . . 0.0 112.896 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 22.6 m -128.92 6.21 2.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 C-N-CA 124.614 1.166 . . . . 0.0 111.431 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -26.31 64.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -164.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -60.23 -22.79 63.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.986 0.914 . . . . 0.0 112.209 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -103.94 -3.23 25.0 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.167 1.387 . . . . 0.0 111.372 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -121.61 -14.8 8.11 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.222 1.009 . . . . 0.0 112.097 -169.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.64 -25.59 53.83 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.126 0.876 . . . . 0.0 112.746 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -76.24 -21.45 56.35 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.764 0.826 . . . . 0.0 112.351 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -127.21 -2.35 6.35 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 124.731 1.212 . . . . 0.0 113.646 -162.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.7 p -77.48 64.6 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 123.24 1.495 . . . . 0.0 110.329 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -159.97 35.92 0.18 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.302 1.441 . . . . 0.0 108.877 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.1 -175.93 33.64 Favored Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.819 1.676 . . . . 0.0 110.377 -173.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.28 172.22 11.5 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.53 2.82 . . . . 0.0 111.442 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.4 tp -137.79 150.62 47.36 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 173.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -143.02 147.03 34.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.075 1.35 . . . . 0.0 107.538 -170.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.9 mm -132.18 144.85 35.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -136.22 154.51 50.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.071 1.748 . . . . 0.0 106.612 162.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -140.03 160.38 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 O-C-N 121.014 -1.053 . . . . 0.0 109.801 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.76 147.25 52.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.862 2.065 . . . . 0.0 105.519 162.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.53 128.47 55.21 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 167.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.9 mp -117.76 -172.82 2.31 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.616 2.366 . . . . 0.0 108.021 -169.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.92 -38.58 88.96 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.323 -0.861 . . . . 0.0 113.303 -166.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.4 mmtm -141.34 25.4 2.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.653 1.181 . . . . 0.0 112.298 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.54 -169.44 37.93 Favored Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mp -135.78 144.2 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.457 1.103 . . . . 0.0 108.437 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -92.61 140.6 29.38 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 160.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -128.47 127.9 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 104.443 -2.428 . . . . 0.0 104.443 175.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -108.89 143.66 18.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 104.776 -2.305 . . . . 0.0 104.776 176.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 131.7 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 -172.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -135.31 167.96 20.07 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.619 0.645 . . . . 0.0 110.206 -167.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -143.4 169.19 18.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.492 1.917 . . . . 0.0 107.726 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.25 163.87 4.67 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 162.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -77.99 61.39 2.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.35 1.06 . . . . 0.0 110.502 177.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 61.0 tp -57.14 -31.02 64.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.46 1.504 . . . . 0.0 111.819 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.8 m -121.15 39.86 3.71 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.596 1.558 . . . . 0.0 109.845 -173.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -51.67 -35.62 43.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.364 1.066 . . . . 0.0 110.603 172.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.9 t0 -128.53 153.25 47.38 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.449 1.5 . . . . 0.0 107.144 164.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.4 tp -157.45 -37.28 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.164 0.986 . . . . 0.0 111.171 -172.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.59 -32.66 71.54 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -92.38 162.88 14.08 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.826 0.822 . . . . 0.0 111.31 -175.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -155.18 138.28 15.57 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -155.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.9 m -138.0 160.38 64.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.279 1.432 . . . . 0.0 108.841 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.3 156.98 12.31 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 124.059 3.173 . . . . 0.0 113.312 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 . . . . . 0 C--O 1.254 1.303 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.352 170.238 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 111.412 0.153 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.28 130.49 44.6 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 125.33 1.452 . . . . 0.0 107.154 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 mm -123.63 151.22 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 120.175 1.352 . . . . 0.0 108.889 -170.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -143.37 151.2 40.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.703 1.601 . . . . 0.0 109.484 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.12 93.5 3.83 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm -66.2 -54.46 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -170.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -155.72 -160.81 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.538 1.535 . . . . 0.0 108.706 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -72.13 -10.96 60.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -175.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -130.74 -40.81 1.2 Allowed 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.273 -0.892 . . . . 0.0 111.686 -166.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.7 m -91.65 132.51 36.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.5 m -135.99 155.94 36.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 164.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.2 pttt -140.4 168.78 18.99 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.29 -0.882 . . . . 0.0 109.82 176.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -149.56 164.67 34.45 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 175.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -125.69 141.21 52.13 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 173.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.7 ttt -139.65 104.95 5.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -167.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -67.04 148.96 51.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-85 -51.83 -42.12 62.31 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.51 -11.88 80.21 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.412 -1.216 . . . . 0.0 113.842 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.9 -41.33 95.69 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.905 1.852 . . . . 0.0 109.214 166.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.3 mt -71.65 -40.98 71.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.179 1.391 . . . . 0.0 108.177 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.52 -35.67 80.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.156 0.435 . . . . 0.0 111.655 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -65.08 -40.46 94.65 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.91 0.862 . . . . 0.0 111.188 -175.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 56.8 mtt-85 -67.02 -15.18 63.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.847 1.259 . . . . 0.0 110.783 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.09 11.18 82.82 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.893 1.235 . . . . 0.0 113.055 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -83.7 -175.31 5.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 170.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -139.04 153.96 48.16 Favored 'General case' 0 CA--C 1.519 -0.231 0 O-C-N 121.247 -0.908 . . . . 0.0 108.566 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.9 ptt-85 -60.74 -29.29 69.3 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.755 1.222 . . . . 0.0 113.611 -172.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -90.6 -42.85 10.55 Favored 'General case' 0 C--O 1.226 -0.17 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -59.04 -34.41 71.89 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.193 0.997 . . . . 0.0 112.776 -174.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -42.25 -58.29 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.532 1.133 . . . . 0.0 109.364 167.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -73.04 -33.3 65.63 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.456 0.702 . . . . 0.0 112.235 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -96.2 4.84 52.13 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -168.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -128.38 88.51 2.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -50.06 -42.9 50.77 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -167.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -30.35 64.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.554 -0.716 . . . . 0.0 111.121 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -79.95 -17.55 52.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.214 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -48.8 76.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 167.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.55 -34.95 62.69 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.216 1.406 . . . . 0.0 112.408 -169.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.06 -34.73 68.55 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.897 1.279 . . . . 0.0 111.525 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -54.71 43.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.492 1.117 . . . . 0.0 108.245 175.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -66.28 -37.7 86.08 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.482 1.113 . . . . 0.0 110.665 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -57.75 -36.75 72.53 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 117.913 -1.041 . . . . 0.0 112.098 172.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -68.56 -42.92 77.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.524 1.511 . . . . 0.0 110.629 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 m -73.01 -41.31 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 121.167 -0.958 . . . . 0.0 111.075 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.2 mmt -59.2 -41.86 89.52 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.38 0.672 . . . . 0.0 110.38 170.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.89 -42.95 98.99 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.576 0.625 . . . . 0.0 111.229 176.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -8.3 15.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.554 1.541 . . . . 0.0 112.031 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.53 -3.82 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.441 1.896 . . . . 0.0 109.566 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -56.71 -28.29 60.69 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -163.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.15 -15.09 59.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.474 1.034 . . . . 0.0 113.047 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -118.68 -31.45 4.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.592 1.157 . . . . 0.0 111.162 169.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.44 -26.65 61.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.078 -1.014 . . . . 0.0 111.316 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.87 -15.56 8.94 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.817 1.19 . . . . 0.0 113.703 175.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -122.59 13.91 10.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.542 1.137 . . . . 0.0 111.721 174.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.34 -1.7 8.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.79 1.236 . . . . 0.0 112.385 171.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.0 p -75.97 68.22 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 124.848 1.259 . . . . 0.0 110.091 167.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -152.96 27.63 0.53 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.162 0.985 . . . . 0.0 110.554 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.73 178.73 46.41 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.975 1.274 . . . . 0.0 110.579 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.45 174.15 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 124.113 3.209 . . . . 0.0 111.818 -178.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -128.37 152.58 48.01 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.873 1.269 . . . . 0.0 107.776 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -140.17 151.22 45.07 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.304 1.842 . . . . 0.0 106.939 -172.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -134.27 144.12 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.949 0.795 . . . . 0.0 109.046 -172.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -137.49 155.6 49.1 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.609 1.963 . . . . 0.0 107.066 164.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.9 p -147.92 156.48 9.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 120.435 -1.415 . . . . 0.0 110.036 -172.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.03 145.77 51.65 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 164.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.49 132.43 51.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.15 -177.56 3.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.931 2.493 . . . . 0.0 107.97 -170.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.87 -36.52 79.42 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -164.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 45.8 mmtm -141.63 27.79 1.84 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.405 1.082 . . . . 0.0 112.01 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.66 -171.99 40.08 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -174.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.86 144.51 41.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.897 1.279 . . . . 0.0 108.384 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -94.52 137.35 33.75 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 161.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -126.52 125.43 67.24 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 N-CA-C 104.993 -2.225 . . . . 0.0 104.993 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.5 142.71 18.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.47 147.13 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 118.475 0.579 . . . . 0.0 109.761 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.26 170.19 16.46 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.173 0.989 . . . . 0.0 110.01 -164.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -134.57 160.9 36.63 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 124.099 0.96 . . . . 0.0 111.225 171.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.03 -21.85 46.3 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.196 -1.365 . . . . 0.0 112.258 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -62.23 -21.94 65.55 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.786 0.834 . . . . 0.0 112.492 -175.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.52 -27.92 66.61 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.448 1.099 . . . . 0.0 112.43 171.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 m -134.88 33.21 3.18 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.689 0.796 . . . . 0.0 112.138 -156.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -56.79 -31.92 65.14 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.711 -0.618 . . . . 0.0 111.749 175.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -144.72 -34.48 0.36 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.529 0.732 . . . . 0.0 111.542 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.0 tp 75.32 -28.28 0.19 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 128.34 2.656 . . . . 0.0 113.54 161.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -67.88 -20.32 65.11 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.318 0.647 . . . . 0.0 111.872 167.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.69 155.31 26.75 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.862 -0.524 . . . . 0.0 110.89 174.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.2 tp -146.34 155.69 42.8 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.04 0.936 . . . . 0.0 110.22 -166.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.8 m -63.49 160.12 45.39 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 123.272 0.629 . . . . 0.0 110.381 171.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.44 159.22 8.68 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.943 3.095 . . . . 0.0 113.167 173.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.498 1.919 . . . . 0.0 106.328 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -124.55 75.71 1.43 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -155.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 mm -65.92 153.04 8.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 125.053 1.341 . . . . 0.0 110.106 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -141.11 151.41 43.92 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.02 1.728 . . . . 0.0 110.118 170.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -114.69 89.85 3.2 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.067 1.747 . . . . 0.0 106.502 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -59.49 -53.28 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 34.6 p-10 -154.13 -166.16 2.29 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.778 2.031 . . . . 0.0 106.413 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.33 0.34 25.88 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 120.937 -1.102 . . . . 0.0 113.337 -174.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -126.59 -53.82 1.45 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 124.337 1.055 . . . . 0.0 110.051 -169.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.1 m -80.48 135.88 36.21 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 169.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.3 m -128.9 156.75 41.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 163.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.5 pttt -136.13 170.98 15.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 168.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.32 150.95 32.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -101.29 145.81 28.37 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 164.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.2 ttt -141.29 105.45 4.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 124.488 1.115 . . . . 0.0 108.195 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -66.4 150.72 48.48 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.469 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.9 m-85 -53.01 -42.63 65.81 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.11 -9.39 84.0 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 119.804 -1.189 . . . . 0.0 113.488 -175.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -66.46 -45.14 80.73 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.796 1.798 . . . . 0.0 108.854 165.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 23.0 mt -65.34 -42.15 93.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 C-N-CA 124.959 1.304 . . . . 0.0 107.706 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -62.73 -38.84 92.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.412 0.551 . . . . 0.0 111.627 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.37 -42.56 83.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.376 0.67 . . . . 0.0 110.574 -177.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.4 mtt85 -67.09 -7.96 26.99 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.14 0.976 . . . . 0.0 112.019 170.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.66 8.37 86.12 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.075 0.845 . . . . 0.0 113.058 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -85.7 -171.11 3.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 168.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -143.2 153.96 43.37 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -62.29 -33.34 74.45 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -167.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.13 -43.27 13.19 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -57.46 -35.26 69.92 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.088 0.955 . . . . 0.0 112.749 -172.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -42.61 -56.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.33 1.052 . . . . 0.0 109.475 168.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -77.04 -14.87 59.77 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.274 1.03 . . . . 0.0 113.681 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -118.66 7.09 11.63 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.874 0.87 . . . . 0.0 112.429 -167.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -130.09 86.65 2.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -50.23 -40.07 46.41 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -165.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -30.73 59.92 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.719 -0.613 . . . . 0.0 111.324 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -79.78 -16.73 54.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.296 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.94 -48.19 79.99 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 168.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -54.8 -33.73 61.85 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.212 1.405 . . . . 0.0 112.457 -170.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.36 -35.34 71.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.679 1.192 . . . . 0.0 111.277 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -55.84 29.19 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -63.9 -36.48 84.08 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.468 1.107 . . . . 0.0 110.518 -175.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 72.1 m95 -61.21 -40.02 92.41 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.272 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -69.37 -38.13 77.91 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.666 1.575 . . . . 0.0 111.099 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.6 m -74.15 -40.54 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 121.03 -1.044 . . . . 0.0 111.737 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.1 tpp -60.79 -39.51 89.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.02 172.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.63 -38.93 75.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.698 1.135 . . . . 0.0 111.638 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.3 -8.07 5.29 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.421 1.488 . . . . 0.0 113.478 174.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.0 t -129.58 -10.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 125.596 1.558 . . . . 0.0 110.879 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.98 -29.83 68.71 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -158.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.92 -16.72 45.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.766 0.712 . . . . 0.0 112.571 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -113.43 8.48 17.89 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.188 1.795 . . . . 0.0 110.893 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -131.4 -17.14 2.99 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 125.138 1.375 . . . . 0.0 111.896 -173.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.68 -16.87 18.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -108.73 5.93 25.2 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.953 1.701 . . . . 0.0 112.006 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.54 -3.89 2.96 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.515 1.526 . . . . 0.0 112.776 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.73 67.24 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 123.156 1.455 . . . . 0.0 110.125 169.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -161.33 39.09 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.612 1.565 . . . . 0.0 108.141 -171.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.68 -174.63 27.63 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 125.727 1.632 . . . . 0.0 110.245 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.27 174.34 9.23 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.7 2.933 . . . . 0.0 111.509 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.4 tp -145.66 147.76 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.868 1.267 . . . . 0.0 108.064 173.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -144.13 147.15 33.33 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.022 1.329 . . . . 0.0 107.807 -175.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.7 mm -139.56 140.86 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -173.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -144.26 169.52 17.73 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.621 1.168 . . . . 0.0 109.583 161.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.2 p -146.65 162.45 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.173 -0.955 . . . . 0.0 109.955 -169.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -133.86 148.07 51.24 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 126.685 1.994 . . . . 0.0 105.631 161.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.38 129.2 55.54 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 166.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -119.47 -177.55 3.4 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.557 2.343 . . . . 0.0 108.1 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.66 -35.95 79.43 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -165.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.469 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.2 mmtm -140.96 26.3 2.06 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.478 1.111 . . . . 0.0 112.073 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.26 -171.42 39.25 Favored Glycine 0 C--O 1.228 -0.22 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 -174.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -137.59 144.96 42.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 125.186 1.394 . . . . 0.0 108.111 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -96.43 140.39 31.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 161.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -126.76 128.08 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.57 134.45 60.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 104.078 -2.564 . . . . 0.0 104.078 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.1 m -131.68 135.04 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -127.56 159.46 34.55 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -161.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -150.17 158.57 44.3 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.025 1.33 . . . . 0.0 108.047 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.29 161.35 16.88 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 163.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -60.88 149.05 37.41 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 171.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.7 tt -139.23 106.36 5.47 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.7 p -66.17 -46.37 77.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.214 1.406 . . . . 0.0 111.782 -177.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.1 tptt 64.66 -41.92 0.29 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.965 2.506 . . . . 0.0 112.374 -166.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.41 141.87 21.66 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 125.977 1.711 . . . . 0.0 107.528 166.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.2 tp -161.0 -41.52 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.676 0.79 . . . . 0.0 110.838 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.33 -34.21 76.86 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -171.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -66.34 141.17 58.07 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.773 0.321 . . . . 0.0 110.455 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.64 160.23 30.53 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.9 m -138.03 157.12 73.61 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.298 1.439 . . . . 0.0 108.068 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -84.42 24.89 0.72 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 124.296 3.331 . . . . 0.0 113.401 -170.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 124.26 1.024 . . . . 0.0 109.095 175.344 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.398 0.142 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -138.12 117.52 12.85 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -162.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 mp -112.76 152.92 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 120.649 1.568 . . . . 0.0 108.223 -177.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -137.17 150.58 48.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.387 1.875 . . . . 0.0 109.239 172.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.25 106.3 15.67 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 173.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 38.4 mm -70.69 -54.77 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -179.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -159.11 -168.19 2.28 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.631 1.572 . . . . 0.0 108.665 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -60.29 -15.77 28.24 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.799 1.24 . . . . 0.0 113.475 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -125.57 -46.64 1.73 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.174 -0.953 . . . . 0.0 111.785 -168.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.3 m -87.45 141.5 28.58 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -128.66 157.57 41.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 164.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -133.81 166.57 22.36 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 164.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.446 ' CE1' HG21 ' A' ' 44' ' ' VAL . 46.7 p90 -151.96 170.8 18.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -132.77 136.39 46.3 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -129.76 114.36 15.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 -171.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.97 154.63 39.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.468 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.1 m-85 -55.48 -39.02 69.89 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.389 -0.819 . . . . 0.0 111.58 173.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.34 -25.7 72.52 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-O 119.119 -0.823 . . . . 0.0 113.126 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -37.23 81.69 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.402 1.601 . . . . 0.0 109.736 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 71.1 mt -73.74 -43.18 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.07 -39.95 87.82 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.809 1.244 . . . . 0.0 111.7 176.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.89 -42.36 99.75 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.698 0.799 . . . . 0.0 111.145 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.3 mtt85 -68.19 -12.17 60.5 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.37 173.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 12.57 84.05 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.799 1.19 . . . . 0.0 112.829 -177.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -82.02 -177.72 6.72 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 168.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -132.19 146.89 52.33 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -57.11 -30.37 64.32 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.366 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -82.85 -50.05 9.04 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.933 0.788 . . . . 0.0 109.169 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -55.9 -36.0 67.17 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.228 1.011 . . . . 0.0 112.671 -171.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.72 -56.55 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.587 1.155 . . . . 0.0 109.524 169.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -76.04 -13.78 60.22 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -118.38 7.75 12.02 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.585 0.754 . . . . 0.0 112.32 -167.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -137.62 88.25 2.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.04 -2.207 . . . . 0.0 105.04 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -49.85 -42.86 48.38 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -165.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 -32.25 65.59 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 121.594 -0.691 . . . . 0.0 111.016 -178.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -77.56 -18.84 56.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.072 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -55.44 24.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 165.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -52.14 -33.96 42.42 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.498 1.519 . . . . 0.0 113.171 -166.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -54.52 -40.59 68.75 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.47 1.108 . . . . 0.0 111.264 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -51.29 70.22 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.173 0.989 . . . . 0.0 109.576 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -65.55 -34.61 78.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.019 0.927 . . . . 0.0 110.131 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -62.08 -36.58 82.1 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.613 -1.184 . . . . 0.0 112.446 172.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.36 -46.63 82.58 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 121.082 1.765 . . . . 0.0 110.856 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.446 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.51 -41.49 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 121.78 -0.575 . . . . 0.0 110.762 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 tpp -59.68 -41.86 91.64 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.451 0.7 . . . . 0.0 109.715 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -62.02 -42.16 98.87 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.411 -0.805 . . . . 0.0 111.37 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -64.6 -8.43 14.19 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 126.328 1.851 . . . . 0.0 112.211 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.9 m -125.92 4.08 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.761 1.224 . . . . 0.0 111.907 175.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.47 -25.48 66.06 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -163.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -61.46 -23.25 65.73 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.451 1.023 . . . . 0.0 111.78 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -90.89 -7.59 51.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.584 1.154 . . . . 0.0 111.492 177.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.57 -23.59 2.32 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -157.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.34 -27.27 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.52 1.055 . . . . 0.0 112.539 -176.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -79.45 -10.51 59.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.164 0.985 . . . . 0.0 112.376 176.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -131.97 -10.67 3.4 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.461 1.105 . . . . 0.0 113.82 -163.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.8 m -72.59 3.56 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.73 1.605 . . . . 0.0 113.714 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -58.01 -21.21 43.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.426 1.09 . . . . 0.0 113.302 156.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.76 -175.89 38.31 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.889 1.233 . . . . 0.0 112.191 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -72.53 171.24 17.53 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 112.154 -175.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 28.6 tp -142.26 152.11 42.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.506 1.522 . . . . 0.0 106.936 166.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -142.65 152.06 42.07 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.884 1.674 . . . . 0.0 107.087 -173.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mm -135.18 142.35 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -172.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -139.61 153.7 47.41 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.57 2.348 . . . . 0.0 106.36 170.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.7 p -139.81 160.95 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.048 -1.032 . . . . 0.0 109.217 -178.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -133.92 148.06 51.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 161.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.81 128.27 55.7 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.9 mp -119.22 -175.06 2.85 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.482 2.313 . . . . 0.0 107.939 -169.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -62.92 -36.75 84.43 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -165.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -141.56 25.02 2.04 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.524 1.13 . . . . 0.0 112.4 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.63 -170.72 38.82 Favored Glycine 0 CA--C 1.518 0.27 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 mp -136.9 144.57 43.56 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.061 1.344 . . . . 0.0 108.368 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -93.04 145.87 24.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 160.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.71 129.81 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 176.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.58 137.63 49.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 104.03 -2.582 . . . . 0.0 104.03 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.82 134.78 55.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 119.249 0.931 . . . . 0.0 109.452 175.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.3 p -131.61 176.14 8.57 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.16 0.984 . . . . 0.0 110.391 -157.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -135.19 -178.11 4.95 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.645 1.578 . . . . 0.0 111.148 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -134.18 169.36 17.3 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.73 2.012 . . . . 0.0 108.706 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -139.59 162.62 34.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.146 1.378 . . . . 0.0 108.351 174.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.1 tp -143.77 40.3 1.4 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.504 1.122 . . . . 0.0 109.054 -176.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.9 p -62.23 -12.09 18.4 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -60.46 -24.75 65.49 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 120.475 -1.391 . . . . 0.0 111.999 167.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -76.27 -4.97 44.88 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.413 1.006 . . . . 0.0 112.451 173.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 tt -104.54 -50.09 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.579 1.551 . . . . 0.0 107.612 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.68 -32.73 69.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.979 1.312 . . . . 0.0 111.983 173.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.1 tptt 58.5 175.63 0.06 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.028 2.531 . . . . 0.0 113.702 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.04 163.05 28.38 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.851 0.86 . . . . 0.0 108.868 173.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.61 158.13 73.8 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.135 1.374 . . . . 0.0 108.164 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -84.98 29.97 0.53 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.5 3.467 . . . . 0.0 112.493 -171.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.632 1.973 . . . . 0.0 108.554 -171.761 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -140.05 85.85 2.05 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -150.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 mm -72.35 152.11 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 124.003 0.921 . . . . 0.0 109.357 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -141.98 151.8 42.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.716 1.607 . . . . 0.0 110.178 170.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -113.73 102.43 10.24 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.7 mm -69.04 -53.69 24.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -159.73 -166.6 1.79 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.888 1.675 . . . . 0.0 108.694 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.73 -16.38 60.97 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -126.19 -26.53 3.36 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.643 1.177 . . . . 0.0 112.725 -164.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 73.4 m -115.21 134.76 54.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.553 1.141 . . . . 0.0 108.241 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.6 m -122.44 157.57 27.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 166.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -134.76 168.09 19.66 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 162.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.455 ' CE1' HG22 ' A' ' 44' ' ' VAL . 41.0 p90 -149.77 162.51 40.13 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -117.45 126.76 53.18 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 171.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.8 ttt -115.98 108.26 16.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 125.37 1.468 . . . . 0.0 108.02 -177.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.18 147.89 51.63 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.736 171.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -51.35 -39.33 56.83 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.27 -25.17 71.03 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 118.729 -1.04 . . . . 0.0 113.237 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -70.93 -38.58 72.92 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.773 1.787 . . . . 0.0 110.822 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.1 mt -64.47 -47.27 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -58.93 -43.49 91.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.349 1.459 . . . . 0.0 111.858 174.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.68 -44.98 94.86 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.928 0.891 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -68.62 -5.29 19.17 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.018 0.927 . . . . 0.0 111.733 172.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.75 12.47 84.47 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 124.502 1.049 . . . . 0.0 112.87 175.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -78.58 -175.08 4.15 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 163.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.1 t70 -133.42 144.08 49.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.6 ptt180 -55.36 -33.51 63.47 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.785 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.06 -49.43 15.35 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.778 0.717 . . . . 0.0 109.411 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.405 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.5 mm-40 -59.76 -34.92 73.61 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.973 0.909 . . . . 0.0 112.146 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -49.94 -52.0 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 123.521 0.729 . . . . 0.0 109.566 171.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -65.73 -36.97 85.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.045 0.839 . . . . 0.0 111.243 -177.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -101.29 1.65 38.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -160.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -135.65 91.46 2.71 Favored 'General case' 0 CA--C 1.524 -0.056 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -59.59 -50.78 72.54 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -160.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -31.52 64.72 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 174.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -80.55 -18.51 48.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.52 175.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.96 -52.16 64.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 165.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -52.18 -34.09 43.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.359 1.463 . . . . 0.0 113.098 -168.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -57.52 -37.47 73.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.356 1.063 . . . . 0.0 111.646 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -56.25 24.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.761 0.824 . . . . 0.0 108.92 176.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -62.14 -35.1 77.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.732 0.813 . . . . 0.0 109.888 -176.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 63.9 m95 -65.09 -34.81 79.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.787 -1.101 . . . . 0.0 112.907 171.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -35.62 71.43 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 121.099 1.772 . . . . 0.0 111.277 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.455 HG22 ' CE1' ' A' ' 13' ' ' PHE . 16.7 m -75.02 -36.8 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 121.118 -0.989 . . . . 0.0 111.779 176.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -46.0 80.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 118.986 -0.53 . . . . 0.0 110.255 165.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.67 -34.94 73.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.697 0.681 . . . . 0.0 112.316 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.47 -17.08 11.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 112.578 173.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 30.5 m -134.78 11.67 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.592 1.557 . . . . 0.0 112.46 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -26.65 39.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.526 1.131 . . . . 0.0 113.129 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.63 -22.36 66.36 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -104.6 -39.83 6.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.668 1.187 . . . . 0.0 110.165 173.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -65.71 -21.23 66.51 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.258 -0.877 . . . . 0.0 112.177 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -58.38 -19.98 40.28 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.912 1.687 . . . . 0.0 112.384 171.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -99.7 6.22 45.61 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.415 1.486 . . . . 0.0 111.291 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.82 -4.86 1.05 Allowed 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -173.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -88.12 1.05 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 121.314 1.87 . . . . 0.0 112.397 169.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -57.35 -12.75 2.69 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.217 1.007 . . . . 0.0 112.783 149.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -130.1 -178.21 15.29 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.994 1.759 . . . . 0.0 110.695 176.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.02 177.46 7.73 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.526 2.818 . . . . 0.0 113.172 -166.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.0 tp -141.42 149.63 41.29 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.417 1.487 . . . . 0.0 107.009 166.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -145.1 151.22 38.15 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.255 1.422 . . . . 0.0 107.582 -171.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.6 mm -133.26 144.07 37.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -170.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -140.58 149.94 43.01 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.827 1.651 . . . . 0.0 107.135 163.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.6 155.92 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 120.755 -1.216 . . . . 0.0 110.143 -173.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.71 150.47 36.33 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 161.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.92 148.62 26.14 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 167.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mp -128.89 -177.06 4.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.354 2.662 . . . . 0.0 108.319 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.6 -32.52 73.55 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -169.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.1 mmtm -138.33 19.39 2.76 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.324 1.049 . . . . 0.0 112.663 -176.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 177.5 -164.98 34.46 Favored Glycine 0 C--O 1.225 -0.422 0 O-C-N 121.119 -0.988 . . . . 0.0 111.144 -175.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.5 mp -131.42 145.87 52.0 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.748 1.619 . . . . 0.0 107.264 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -103.19 130.83 50.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 160.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -118.38 128.09 75.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 105.032 -2.211 . . . . 0.0 105.032 178.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -104.41 144.51 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 168.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.87 127.64 40.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -176.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -131.74 170.59 14.6 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 118.902 0.774 . . . . 0.0 111.535 -163.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -131.31 165.04 24.31 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.991 1.317 . . . . 0.0 109.545 163.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.03 139.31 54.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.023 -175.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -145.85 161.9 38.93 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.305 1.842 . . . . 0.0 107.245 166.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -128.74 156.08 44.09 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.808 1.243 . . . . 0.0 108.221 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.3 m 50.92 36.89 16.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.387 1.475 . . . . 0.0 113.631 171.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -55.06 -47.48 74.79 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.561 -0.712 . . . . 0.0 111.062 -171.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -69.47 -4.69 19.79 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.454 1.101 . . . . 0.0 113.244 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.0 mt -125.97 -21.5 4.33 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.711 1.205 . . . . 0.0 111.593 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -132.46 -24.39 2.03 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.974 0.91 . . . . 0.0 112.639 -176.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -112.86 1.67 15.61 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.62 163.45 1.82 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.1 0.56 . . . . 0.0 110.933 162.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.7 m -137.15 158.11 73.17 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.791 1.237 . . . . 0.0 108.263 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -85.58 31.03 0.49 Allowed 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 124.454 3.436 . . . . 0.0 112.491 -173.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.582 1.953 . . . . 0.0 108.393 -172.615 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 ptm . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.61 72.84 1.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.035 1.334 . . . . 0.0 107.959 -166.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 mm -62.03 151.88 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 124.923 1.289 . . . . 0.0 109.468 175.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -147.67 127.24 13.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.855 1.262 . . . . 0.0 110.147 172.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -82.22 110.38 17.36 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.0 mm -74.53 -55.71 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -156.86 -165.19 1.79 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.406 1.483 . . . . 0.0 108.643 -177.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.68 -20.86 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.14 0.976 . . . . 0.0 113.474 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -124.67 -42.3 2.08 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.966 0.906 . . . . 0.0 111.613 -166.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 55.6 m -92.2 137.85 32.02 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 m -127.07 155.77 38.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 166.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -129.73 171.57 12.53 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 165.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -151.42 152.42 33.04 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -105.56 142.51 35.18 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 166.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.9 ttt -138.24 104.75 5.28 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 125.017 1.327 . . . . 0.0 108.063 -172.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -67.06 154.07 42.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.493 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -51.61 -33.35 32.6 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.23 -11.2 76.26 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 119.897 -1.144 . . . . 0.0 113.41 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -68.69 -40.54 80.03 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.702 1.751 . . . . 0.0 108.846 166.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.4 mt -64.12 -46.38 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.162 1.385 . . . . 0.0 108.698 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.71 -35.3 80.36 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.47 0.308 . . . . 0.0 111.346 -177.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.33 -43.38 98.95 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.362 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.1 mtt-85 -69.35 -7.08 34.15 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.355 1.062 . . . . 0.0 111.455 174.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.62 84.6 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.412 1.006 . . . . 0.0 112.731 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -83.89 -175.13 5.66 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -141.56 148.7 39.73 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -57.01 -36.64 70.66 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.142 0.883 . . . . 0.0 111.397 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -76.06 -45.06 36.1 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.05 -37.06 81.27 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.256 -0.902 . . . . 0.0 111.866 -173.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -54.71 -44.81 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 124.146 0.978 . . . . 0.0 110.126 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -69.79 -26.48 64.29 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -120.98 8.73 10.47 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -157.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -131.48 100.59 5.2 Favored 'General case' 0 N--CA 1.458 -0.057 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -58.18 -16.69 14.48 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -165.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.34 -31.09 6.69 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.53 1.532 . . . . 0.0 111.777 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -77.71 -18.0 57.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.232 0.924 . . . . 0.0 111.124 176.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.3 p -54.39 -55.18 31.24 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.932 0.893 . . . . 0.0 109.329 165.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -56.89 -31.3 64.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.376 1.87 . . . . 0.0 112.865 -169.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -58.94 -36.13 74.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.453 1.101 . . . . 0.0 111.109 -177.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -55.69 29.04 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -62.82 -36.1 82.09 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.095 0.958 . . . . 0.0 109.809 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -62.15 -38.81 90.4 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.765 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.66 -34.74 77.54 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.39 1.45 . . . . 0.0 110.698 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.8 m -77.59 -39.44 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 120.921 -1.112 . . . . 0.0 111.795 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -42.6 77.03 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.846 -0.533 . . . . 0.0 110.098 169.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.44 -40.18 85.96 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.051 0.541 . . . . 0.0 111.849 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -60.8 -11.23 7.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.903 1.281 . . . . 0.0 112.936 173.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -123.04 5.11 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.304 1.842 . . . . 0.0 109.571 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -57.14 -31.9 65.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.245 -1.534 . . . . 0.0 114.031 -166.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.15 -12.75 42.88 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -114.95 -37.28 4.2 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.765 1.626 . . . . 0.0 110.318 175.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -58.66 -29.32 66.49 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.491 -0.755 . . . . 0.0 110.948 174.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -59.18 -13.29 6.92 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.112 1.324 . . . . 0.0 113.863 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -124.86 14.85 8.6 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.665 1.186 . . . . 0.0 111.829 173.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -128.76 -4.16 5.23 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.696 1.198 . . . . 0.0 112.973 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.4 p -78.83 62.11 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 123.362 1.553 . . . . 0.0 110.858 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -159.48 32.37 0.2 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.8 1.24 . . . . 0.0 109.314 -168.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.48 -177.16 38.22 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.753 1.644 . . . . 0.0 109.795 -177.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.6 170.89 16.5 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.294 2.663 . . . . 0.0 111.377 -179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.39 148.41 46.18 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -138.24 148.52 44.83 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.6 mm -139.34 141.41 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -143.78 161.78 37.74 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.664 0.786 . . . . 0.0 109.461 156.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.4 p -152.23 157.76 4.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 O-C-N 121.203 -0.936 . . . . 0.0 109.868 -171.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -144.74 149.56 35.75 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 162.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.41 146.97 32.52 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 165.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.07 -179.18 4.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.103 2.561 . . . . 0.0 108.163 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -62.08 -31.06 71.46 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -166.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.3 mmtm -140.39 22.0 2.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.25 1.02 . . . . 0.0 112.197 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.92 -168.79 37.99 Favored Glycine 0 CA--C 1.519 0.323 0 O-C-N 121.059 -1.026 . . . . 0.0 111.275 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.0 mp -132.38 146.38 51.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 125.793 1.637 . . . . 0.0 107.703 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.81 131.29 52.47 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 160.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -116.15 135.07 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.819 -2.289 . . . . 0.0 104.819 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -111.82 141.96 25.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 165.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.92 144.06 37.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.49 161.71 34.28 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -161.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.3 mppt? -143.31 163.96 31.56 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.973 1.709 . . . . 0.0 108.027 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -137.78 28.56 2.65 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.521 1.128 . . . . 0.0 110.829 -170.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -93.06 14.2 18.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.696 0.798 . . . . 0.0 112.951 -168.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.0 tp -52.58 -37.18 57.5 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.678 0.791 . . . . 0.0 111.432 178.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.6 m -64.09 1.5 0.69 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.369 1.468 . . . . 0.0 114.183 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -53.3 -29.58 34.17 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.998 -1.064 . . . . 0.0 110.249 162.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -113.52 121.29 43.8 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 164.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.3 tp -160.29 142.68 13.11 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.3 t70 61.45 -21.89 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.826 2.451 . . . . 0.0 115.773 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -62.15 153.62 29.63 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 119.34 0.973 . . . . 0.0 111.016 176.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.65 161.09 24.09 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.624 0.77 . . . . 0.0 109.665 174.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -136.92 161.97 58.5 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 125.385 1.474 . . . . 0.0 108.645 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -53.06 156.13 10.39 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.822 3.015 . . . . 0.0 113.401 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.798 1.639 . . . . 0.0 107.748 178.94 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -143.08 128.01 18.39 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 -150.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.47 150.49 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 120.285 1.402 . . . . 0.0 108.675 -168.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.9 151.51 42.72 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.012 1.325 . . . . 0.0 110.032 174.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.91 103.58 11.08 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.8 mm -69.72 -55.14 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -157.18 -171.41 3.61 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.038 1.735 . . . . 0.0 108.058 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.07 -13.14 14.83 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.56 1.144 . . . . 0.0 113.593 -175.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -123.04 -52.25 1.87 Allowed 'General case' 0 C--N 1.342 0.252 0 O-C-N 121.048 -1.033 . . . . 0.0 110.851 -171.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.0 m -80.93 141.36 34.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -128.81 158.77 41.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.1 pttt -134.84 164.07 28.39 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 164.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -149.85 165.47 32.44 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -124.78 136.62 54.01 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 172.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.3 ttt -133.21 116.34 16.09 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.7 m -76.61 156.57 32.62 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.4 m-85 -55.5 -43.61 75.82 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.207 -0.933 . . . . 0.0 111.908 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.38 -9.85 86.59 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-O 118.587 -1.118 . . . . 0.0 113.451 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -66.02 -36.22 82.67 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.883 1.841 . . . . 0.0 109.062 166.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.94 -41.03 31.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.151 1.38 . . . . 0.0 107.672 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.88 -37.9 83.78 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.349 0.522 . . . . 0.0 111.502 174.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.67 -42.14 91.68 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.878 0.847 . . . . 0.0 110.895 -177.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.7 mtt85 -68.47 -8.99 45.82 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.382 172.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.95 12.98 83.87 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.457 1.027 . . . . 0.0 112.866 177.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.56 -170.74 3.26 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 165.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -142.37 150.92 41.34 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 172.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -60.94 -32.4 71.92 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -169.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -84.84 -42.65 14.89 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -57.86 -36.09 71.85 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 124.092 0.957 . . . . 0.0 112.419 -173.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.2 mm -44.15 -51.55 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.703 1.201 . . . . 0.0 110.586 169.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -78.43 -14.28 59.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.75 7.82 9.96 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -166.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -125.32 99.1 5.91 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.552 1.541 . . . . 0.0 106.958 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -54.82 -20.57 8.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.732 1.613 . . . . 0.0 115.068 -169.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.87 -30.62 9.26 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.963 0.801 . . . . 0.0 112.02 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -78.49 -16.7 57.24 Favored 'General case' 0 C--N 1.338 0.079 0 CA-C-N 118.92 0.782 . . . . 0.0 111.281 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 12.9 p -54.06 -58.56 6.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 166.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.39 -31.42 63.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.438 1.895 . . . . 0.0 112.486 -166.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -59.89 -35.22 74.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 111.307 -176.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -56.86 16.28 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 122.301 1.048 . . . . 0.0 108.548 175.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.25 -37.91 89.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.451 1.1 . . . . 0.0 110.395 -174.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -58.63 -37.0 74.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.969 172.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.52 -43.44 76.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.347 1.431 . . . . 0.0 110.388 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.8 m -71.13 -40.89 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.935 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.7 mmt -58.53 -43.28 89.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 122.802 0.441 . . . . 0.0 110.647 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -60.27 -42.09 94.64 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.584 0.629 . . . . 0.0 111.256 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -64.21 -6.0 5.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.37 1.868 . . . . 0.0 112.161 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -126.77 -0.89 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.635 1.974 . . . . 0.0 109.571 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -57.31 -28.83 63.41 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -161.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.13 -22.26 60.59 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.055 0.843 . . . . 0.0 112.415 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -100.43 -0.91 37.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.065 1.346 . . . . 0.0 111.616 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.12 -20.37 3.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.276 1.03 . . . . 0.0 111.801 -163.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -59.71 -14.48 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.942 1.297 . . . . 0.0 114.316 -174.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -126.01 18.31 7.82 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.522 1.529 . . . . 0.0 110.486 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.24 27.74 1.56 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.143 1.377 . . . . 0.0 112.061 -174.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.28 48.52 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 123.098 1.428 . . . . 0.0 107.716 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -122.35 35.48 4.87 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.469 2.308 . . . . 0.0 108.053 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.77 -177.24 37.2 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 126.418 1.961 . . . . 0.0 109.441 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -69.88 170.93 15.56 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.501 2.8 . . . . 0.0 111.943 -176.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.42 152.37 48.31 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 172.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -148.62 145.04 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.367 1.467 . . . . 0.0 107.185 -163.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.7 mm -135.33 145.41 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -133.21 148.51 52.03 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 158.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.3 p -136.22 157.77 37.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 171.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.403 HE22 HD11 ' A' ' 74' ' ' ILE . 1.2 pm0 -146.25 151.57 37.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 159.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.01 143.54 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -125.78 -171.87 2.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.215 2.606 . . . . 0.0 107.691 -173.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.11 -37.96 84.61 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -166.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.3 mmtm -141.78 27.45 1.83 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.363 1.065 . . . . 0.0 112.379 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.74 -169.07 38.92 Favored Glycine 0 C--O 1.23 -0.139 0 O-C-N 120.929 -1.107 . . . . 0.0 110.478 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mp -135.26 144.35 46.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.222 1.009 . . . . 0.0 109.236 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -93.2 133.93 35.9 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.53 132.1 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.403 HD11 HE22 ' A' ' 65' ' ' GLN . 1.4 mp -112.24 143.31 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 170.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.52 136.33 52.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 118.839 0.745 . . . . 0.0 109.365 171.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -129.69 174.98 9.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.182 0.993 . . . . 0.0 110.146 -160.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -135.19 -177.85 4.83 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.239 1.416 . . . . 0.0 110.721 172.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -134.71 163.51 29.61 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.522 1.929 . . . . 0.0 108.254 175.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -147.09 -41.46 0.18 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.107 0.563 . . . . 0.0 111.669 -177.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -149.39 142.15 24.61 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 m -68.13 56.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.351 2.26 . . . . 0.0 112.742 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -56.87 -43.15 80.95 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.467 -1.395 . . . . 0.0 110.691 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -77.75 35.63 0.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.318 1.447 . . . . 0.0 111.786 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.6 tt -154.85 -43.38 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.914 2.086 . . . . 0.0 107.6 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.36 -45.8 89.5 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.783 0.833 . . . . 0.0 110.848 168.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -69.62 152.09 45.16 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 168.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.73 149.56 46.44 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -141.27 161.88 50.62 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.613 1.565 . . . . 0.0 108.402 178.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.81 157.05 10.89 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.047 3.165 . . . . 0.0 113.212 174.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.968 1.707 . . . . 0.0 107.749 179.234 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptm . . . . . 0 N--CA 1.496 1.839 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -134.75 130.71 36.62 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.0 mm -122.31 152.24 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 125.057 1.343 . . . . 0.0 108.907 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.01 152.18 46.05 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.12 1.368 . . . . 0.0 110.121 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -119.59 92.61 3.83 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.038 1.735 . . . . 0.0 106.461 177.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.9 -53.51 40.8 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -157.28 -162.98 1.29 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.006 1.722 . . . . 0.0 108.24 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -67.48 -17.12 64.57 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -123.81 -50.26 1.84 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.411 -0.805 . . . . 0.0 110.852 -164.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 27.8 m -81.42 133.07 35.36 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 170.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -128.94 159.9 40.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 163.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.4 pttt -139.13 167.14 22.73 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 164.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 44' ' ' VAL . 53.8 p90 -148.95 166.69 27.86 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -125.38 133.99 52.33 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 106.128 -1.805 . . . . 0.0 106.128 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.4 tpt -129.42 107.23 9.34 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -169.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.67 154.62 41.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.9 m-85 -53.52 -37.91 63.26 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.707 -0.621 . . . . 0.0 111.893 175.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.54 -26.08 74.85 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.304 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.81 -30.66 69.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.692 1.746 . . . . 0.0 110.316 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.97 -44.62 28.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -58.9 -39.82 82.62 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 124.835 1.254 . . . . 0.0 111.631 175.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.98 -44.16 97.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.96 0.886 . . . . 0.0 111.257 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 79.3 mtt85 -72.09 -5.6 36.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.677 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 11.64 85.02 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.719 1.152 . . . . 0.0 112.903 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -85.05 -175.09 5.61 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 168.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -135.33 146.54 48.54 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 173.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -52.86 -35.28 57.4 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.991 0.814 . . . . 0.0 111.119 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -80.39 -45.11 18.25 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.537 1.135 . . . . 0.0 108.967 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -61.18 -36.09 78.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.213 1.005 . . . . 0.0 112.319 -176.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.88 -49.87 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -84.21 -26.4 28.76 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -97.39 -17.08 19.92 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.937 0.495 . . . . 0.0 111.316 -167.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.8 -171.48 3.54 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 158.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -135.98 -48.01 0.67 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.186 -0.946 . . . . 0.0 111.136 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -34.64 76.54 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.369 0.668 . . . . 0.0 110.605 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -79.84 -12.54 59.75 Favored 'General case' 0 C--N 1.34 0.182 0 O-C-N 121.49 -0.756 . . . . 0.0 111.925 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.71 -41.5 75.26 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 168.405 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.603 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 15.7 tt0 -56.28 -30.98 63.19 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.128 1.371 . . . . 0.0 113.013 -171.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.76 -33.5 75.79 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.653 1.981 . . . . 0.0 111.033 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -44.88 92.24 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.603 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -71.12 -40.68 71.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.652 0.781 . . . . 0.0 108.958 -173.885 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -56.45 -40.44 74.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.369 171.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.05 -22.26 65.6 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.396 0.998 . . . . 0.0 113.08 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -103.99 -38.09 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 119.846 1.203 . . . . 0.0 111.853 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -43.27 64.68 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 163.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.86 -44.64 66.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 123.779 0.832 . . . . 0.0 112.441 173.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -62.62 -7.37 4.64 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 t -129.02 -2.95 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 126.059 1.744 . . . . 0.0 110.003 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -59.99 -29.88 68.75 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.515 -1.365 . . . . 0.0 114.517 -159.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.84 -11.69 40.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.413 0.685 . . . . 0.0 112.46 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -113.82 -31.73 6.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.229 1.812 . . . . 0.0 110.623 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.26 -28.27 67.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.415 1.007 . . . . 0.0 111.009 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.28 -22.31 40.7 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.139 0.881 . . . . 0.0 112.747 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -83.75 -10.65 57.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.904 0.775 . . . . 0.0 112.335 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -138.15 4.83 2.5 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.294 1.038 . . . . 0.0 113.581 -165.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.59 77.6 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-O 122.801 1.286 . . . . 0.0 109.033 174.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -147.82 22.88 1.11 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.918 1.287 . . . . 0.0 110.827 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.25 176.89 42.59 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.796 1.189 . . . . 0.0 110.435 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.74 164.69 33.12 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.798 2.999 . . . . 0.0 112.03 -174.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.1 mt -87.53 158.93 18.8 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 164.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -143.18 141.75 31.23 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.57 143.17 39.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.386 0.994 . . . . 0.0 108.727 -172.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -137.38 155.66 49.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.147 1.379 . . . . 0.0 107.718 165.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.91 160.21 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 O-C-N 120.744 -1.222 . . . . 0.0 110.178 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.05 152.15 44.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 157.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.0 143.59 30.95 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.131 0.573 . . . . 0.0 109.618 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -125.93 -175.6 3.4 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.255 2.622 . . . . 0.0 107.599 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.9 -35.54 80.38 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -164.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.6 mmtm -141.07 25.54 2.09 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 112.14 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.91 -173.45 42.49 Favored Glycine 0 C--O 1.228 -0.27 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -175.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.52 144.86 46.54 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.478 1.111 . . . . 0.0 108.82 177.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -94.54 129.49 41.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 161.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.95 127.24 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mp -95.8 147.09 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 166.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.97 139.99 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 172.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -134.94 168.47 19.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.097 0.959 . . . . 0.0 108.622 -173.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 mppt? . . . . . 0 N--CA 1.472 0.645 0 C-N-CA 124.505 1.122 . . . . 0.0 109.903 -178.47 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.737 0.303 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -124.98 77.95 1.66 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -160.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 mm -68.43 150.45 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.763 1.225 . . . . 0.0 109.327 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -151.66 102.25 2.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.355 1.062 . . . . 0.0 110.226 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -72.78 118.38 15.65 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.267 -1.521 . . . . 0.0 106.907 171.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 32.9 mm -81.92 -53.54 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -163.62 -175.14 4.01 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.894 1.677 . . . . 0.0 108.873 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.08 -14.99 1.81 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.366 1.467 . . . . 0.0 114.931 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -119.19 -27.26 5.71 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.265 1.426 . . . . 0.0 112.802 -167.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -129.81 140.79 50.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.457 1.103 . . . . 0.0 109.27 -172.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.8 m -130.07 153.64 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 106.219 -1.771 . . . . 0.0 106.219 166.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -132.29 168.31 18.31 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 168.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.521 ' CE1' HG21 ' A' ' 44' ' ' VAL . 40.8 p90 -155.0 165.17 37.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -118.69 140.91 49.17 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -132.38 112.13 11.91 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.9 m -73.19 156.97 38.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.1 m-85 -52.06 -43.44 63.81 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 121.985 -0.447 . . . . 0.0 111.745 173.518 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -78.81 -12.07 84.57 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 119.707 -1.235 . . . . 0.0 113.817 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -34.39 75.54 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.688 1.744 . . . . 0.0 109.422 165.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.15 -42.11 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -61.33 -37.54 83.65 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.735 0.698 . . . . 0.0 111.515 175.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.47 -42.51 98.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.838 0.828 . . . . 0.0 110.898 -176.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -72.39 -4.83 32.44 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.564 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.62 11.19 85.52 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.479 1.038 . . . . 0.0 113.071 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -82.86 -173.13 4.5 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 168.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -138.53 147.05 42.67 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 174.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.6 ptt85 -56.93 -35.5 69.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.676 0.671 . . . . 0.0 111.597 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.62 -45.52 29.8 Favored 'General case' 0 C--O 1.226 -0.147 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.97 -37.02 78.39 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 121.429 -0.795 . . . . 0.0 111.838 -172.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -53.32 -47.43 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.58 0.752 . . . . 0.0 109.947 171.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 m95 -68.64 -21.71 64.45 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.266 0.939 . . . . 0.0 112.943 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -120.56 4.06 10.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -161.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -137.87 83.56 1.99 Allowed 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -47.43 -42.77 23.06 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.58 -32.09 63.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.479 -0.763 . . . . 0.0 111.288 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -77.82 -19.66 54.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.95 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -51.96 64.89 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 166.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -52.42 -34.37 48.1 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.229 1.412 . . . . 0.0 113.228 -169.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.4 -36.56 69.06 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.797 1.239 . . . . 0.0 111.646 -179.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -53.06 62.63 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.093 0.957 . . . . 0.0 109.069 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -66.36 -32.42 73.8 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.398 1.079 . . . . 0.0 110.66 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -65.26 -44.43 88.12 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.889 170.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.94 -41.56 95.41 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.079 1.309 . . . . 0.0 110.878 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.521 HG21 ' CE1' ' A' ' 13' ' ' PHE . 27.9 m -68.96 -44.01 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 O-C-N 121.251 -0.906 . . . . 0.0 112.147 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 43.9 tpp -59.35 -39.56 83.63 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.03 -38.33 88.29 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.529 -0.732 . . . . 0.0 111.894 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.16 -13.8 41.38 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.52 1.528 . . . . 0.0 113.221 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 33.6 m -123.33 -5.34 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.361 1.064 . . . . 0.0 111.939 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -18.15 12.08 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -66.1 -16.9 64.34 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 120.277 1.399 . . . . 0.0 112.437 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -113.63 -36.88 4.76 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.483 0.713 . . . . 0.0 110.87 162.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -68.1 -13.07 61.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 118.003 -0.999 . . . . 0.0 112.473 -175.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -57.13 -27.41 61.82 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.486 1.494 . . . . 0.0 112.029 168.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -79.42 -5.87 55.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.285 0.634 . . . . 0.0 111.998 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.02 36.96 1.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.641 1.176 . . . . 0.0 111.205 -166.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.8 p -117.47 66.04 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 123.628 1.68 . . . . 0.0 106.577 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -153.18 36.41 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 113.942 -1.481 . . . . 0.0 109.251 -168.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.45 -176.25 39.21 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 126.087 1.803 . . . . 0.0 109.753 -173.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.45 170.07 12.95 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.459 2.773 . . . . 0.0 110.905 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.46 HD23 ' H ' ' A' ' 61' ' ' TRP . 0.5 OUTLIER -137.36 147.57 45.61 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.331 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.46 ' H ' HD23 ' A' ' 60' ' ' LEU . 90.4 m95 -143.74 144.19 31.72 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.557 1.543 . . . . 0.0 107.281 -164.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.454 HG23 HG12 ' A' ' 75' ' ' VAL . 3.8 mm -137.19 138.1 45.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -170.041 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -136.28 147.66 47.6 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.441 1.896 . . . . 0.0 107.641 169.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.37 154.74 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 O-C-N 120.975 -1.078 . . . . 0.0 109.671 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -144.85 150.22 36.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 161.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.68 146.94 26.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 169.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.67 179.81 5.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.976 2.51 . . . . 0.0 108.315 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -58.39 -36.48 73.62 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -168.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.506 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 34.0 mmtp -139.16 27.14 2.37 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.119 0.967 . . . . 0.0 112.329 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.08 -168.32 37.38 Favored Glycine 0 CA--C 1.521 0.409 0 O-C-N 121.005 -1.059 . . . . 0.0 111.692 -174.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -133.0 145.19 50.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.112 1.765 . . . . 0.0 107.516 176.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -103.09 136.52 42.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 159.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.443 HD13 ' CE2' ' A' ' 13' ' ' PHE . 1.0 OUTLIER -123.58 131.38 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 178.767 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -111.84 136.51 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 168.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.454 HG12 HG23 ' A' ' 62' ' ' ILE . 4.2 m -131.08 141.94 44.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 119.569 1.077 . . . . 0.0 108.696 172.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.2 p -134.38 162.91 30.89 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -161.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.338 0 C-N-CA 126.28 1.832 . . . . 0.0 107.492 174.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ptm . . . . . 0 N--CA 1.495 1.805 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.81 76.93 1.24 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.155 1.382 . . . . 0.0 107.794 -161.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -66.83 153.01 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 124.523 1.129 . . . . 0.0 109.599 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -146.76 138.17 24.3 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.972 1.309 . . . . 0.0 109.413 168.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mmt85 -89.85 126.45 35.71 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.98 -1.075 . . . . 0.0 108.142 166.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.453 HD11 ' HG2' ' A' ' 12' ' ' LYS . 24.1 mm -83.01 -61.94 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 172.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -153.55 17.7 0.53 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 111.526 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 74.16 -34.63 0.28 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 128.074 2.549 . . . . 0.0 113.603 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -68.56 -38.48 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.428 1.013 . . . . 0.0 108.859 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.1 m -110.12 140.4 44.24 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.642 1.577 . . . . 0.0 107.484 168.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 m -129.1 162.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 166.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HG2' HD11 ' A' ' 6' ' ' ILE . 49.9 pttt -135.39 172.74 12.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.763 -1.211 . . . . 0.0 109.683 165.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -144.8 160.55 41.08 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 168.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -118.27 149.5 41.02 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 162.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 4.8 ttt -144.64 103.41 3.93 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 -168.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.8 m -67.48 153.19 44.27 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.9 m-85 -53.12 -31.63 43.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.81 -25.51 73.06 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-O 119.066 -0.852 . . . . 0.0 113.663 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.86 -37.0 75.98 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.757 1.779 . . . . 0.0 109.739 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 11.3 mt -68.49 -44.71 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.405 1.482 . . . . 0.0 109.178 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -58.46 -38.92 78.55 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.587 1.155 . . . . 0.0 111.439 174.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.66 -40.7 97.86 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.518 0.675 . . . . 0.0 111.69 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtt-85 -68.51 -11.84 60.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.016 1.327 . . . . 0.0 111.27 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.51 3.19 78.36 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.61 1.576 . . . . 0.0 112.179 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.404 ' CE2' ' HG2' ' A' ' 39' ' ' GLU . 24.7 m-85 -90.19 -178.41 5.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.788 1.235 . . . . 0.0 110.081 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -137.89 153.33 49.55 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -60.65 -31.92 71.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.467 -170.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -81.79 -46.26 14.44 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -56.83 -35.73 69.16 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.0 0.92 . . . . 0.0 112.751 -171.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.1 mm -44.39 -53.49 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.604 1.162 . . . . 0.0 109.339 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 50.1 m95 -75.01 -17.07 60.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -115.33 8.95 15.53 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.328 0.651 . . . . 0.0 112.334 -165.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -142.03 92.42 2.44 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -50.86 -46.97 60.51 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.556 1.071 . . . . 0.0 112.655 -166.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.01 -21.52 65.94 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.565 -0.71 . . . . 0.0 111.515 -176.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -98.67 -5.63 31.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.062 1.345 . . . . 0.0 111.632 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.92 -49.85 14.63 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -55.78 -32.74 63.74 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.538 1.135 . . . . 0.0 112.921 -170.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.404 ' HG2' ' CE2' ' A' ' 25' ' ' PHE . 3.1 pp20? -53.15 -37.13 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.798 0.839 . . . . 0.0 111.848 174.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -59.07 6.0 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.412 ' HA ' HG22 ' A' ' 44' ' ' VAL . 76.9 m-85 -64.24 -40.02 95.16 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.073 1.349 . . . . 0.0 110.335 -173.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -61.13 -36.92 81.03 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 117.729 -1.129 . . . . 0.0 112.434 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -72.42 -37.18 68.7 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.669 1.577 . . . . 0.0 111.549 178.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 41' ' ' PHE . 17.6 m -70.47 -41.45 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 120.006 1.276 . . . . 0.0 111.152 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -42.08 87.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.934 -0.479 . . . . 0.0 110.445 170.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -58.06 -40.89 82.11 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 122.757 0.423 . . . . 0.0 111.269 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.57 -5.25 2.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.927 1.691 . . . . 0.0 112.78 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.5 t -131.94 2.76 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 126.404 1.881 . . . . 0.0 109.895 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -55.76 -37.47 68.57 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.162 -1.587 . . . . 0.0 113.985 -162.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.38 -8.76 27.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -119.06 -36.13 3.47 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.787 2.035 . . . . 0.0 109.901 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -57.17 -31.85 65.82 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.931 0.892 . . . . 0.0 110.984 170.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -57.39 -21.98 39.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.68 1.127 . . . . 0.0 112.854 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -83.97 -14.23 51.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.893 0.77 . . . . 0.0 112.381 176.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.95 -0.42 3.1 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -165.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.57 69.27 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 122.994 1.378 . . . . 0.0 110.404 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -155.73 27.73 0.38 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.062 1.345 . . . . 0.0 110.195 -173.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.44 -178.82 38.82 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.021 1.296 . . . . 0.0 110.557 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.9 169.49 18.97 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.762 2.975 . . . . 0.0 111.962 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.4 tp -129.72 148.15 51.57 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.48 1.512 . . . . 0.0 107.12 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -140.02 146.87 39.58 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -170.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -135.52 142.76 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -140.13 91.21 2.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.95 1.3 . . . . 0.0 108.196 165.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.82 154.59 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.521 0.728 . . . . 0.0 109.078 166.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.0 152.05 32.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 152.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.57 143.29 32.93 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 123.612 0.765 . . . . 0.0 109.883 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.475 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.7 mp -129.46 -176.03 3.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.968 2.507 . . . . 0.0 108.306 -172.059 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.04 -34.77 76.87 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -140.42 21.69 2.38 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.303 1.041 . . . . 0.0 112.355 -177.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.9 -170.15 40.48 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mp -134.74 142.62 46.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.863 1.265 . . . . 0.0 109.262 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.475 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 20.8 mt-10 -94.57 143.5 26.37 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 162.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.93 123.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.4 mp -92.42 145.64 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 104.675 -2.343 . . . . 0.0 104.675 167.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.65 131.73 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.84 159.41 39.89 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -165.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 mppt? . . . . . 0 C--O 1.234 0.244 0 C-N-CA 126.97 2.108 . . . . 0.0 108.39 174.831 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.797 0.332 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -127.4 78.09 1.79 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -151.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 mp -76.8 153.71 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.494 1.118 . . . . 0.0 109.772 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -134.69 156.14 49.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.312 2.245 . . . . 0.0 108.154 170.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -124.29 89.34 3.06 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 176.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.0 -52.83 56.55 Favored 'Isoleucine or valine' 0 C--N 1.345 0.399 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -157.14 -164.1 1.53 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.189 1.796 . . . . 0.0 107.206 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -72.49 -9.93 59.17 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -176.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -126.6 -40.63 1.91 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.042 -1.036 . . . . 0.0 112.184 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.8 m -92.86 134.53 34.99 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 165.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 m -128.88 156.55 41.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 165.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -142.13 169.66 17.18 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 121.018 -1.052 . . . . 0.0 108.558 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.559 ' CD1' HG21 ' A' ' 44' ' ' VAL . 38.1 p90 -153.52 163.62 39.65 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 172.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -115.31 143.12 45.74 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -136.85 108.24 6.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.81 1.244 . . . . 0.0 107.872 -175.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -68.1 153.94 42.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-30 -52.2 -38.7 58.66 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 122.851 0.461 . . . . 0.0 112.121 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.79 -25.52 70.58 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 119.24 -0.755 . . . . 0.0 113.385 -177.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -69.31 -38.71 78.38 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.995 1.397 . . . . 0.0 109.979 175.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.54 -43.56 71.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 125.452 1.501 . . . . 0.0 108.345 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.92 -40.84 85.75 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.03 1.332 . . . . 0.0 111.581 175.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -62.85 -42.06 99.6 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.566 0.698 . . . . 0.0 111.237 -177.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -68.46 -13.19 62.14 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.916 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.1 13.32 83.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.734 1.159 . . . . 0.0 112.953 -176.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -82.86 -173.74 4.85 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.431 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.4 t70 -141.89 147.49 37.21 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -53.72 -35.77 61.54 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.834 0.743 . . . . 0.0 111.443 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.78 -42.1 25.15 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.313 0.506 . . . . 0.0 109.863 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.431 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.92 -37.71 85.68 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.05 -1.031 . . . . 0.0 111.058 -175.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.63 -43.87 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.797 1.239 . . . . 0.0 110.254 170.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.59 -28.35 66.86 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.121 0.873 . . . . 0.0 113.057 177.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -120.92 8.79 10.51 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -155.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -132.18 98.17 4.34 Favored 'General case' 0 C--N 1.335 -0.053 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.2 ttp85 -54.27 -23.45 15.04 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.245 1.418 . . . . 0.0 114.74 -169.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 -31.16 10.69 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 118.902 0.774 . . . . 0.0 111.864 178.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -79.83 -17.47 53.2 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.068 0.849 . . . . 0.0 111.316 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 p -59.35 -53.3 59.81 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 167.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -30.94 63.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.316 1.846 . . . . 0.0 113.25 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.411 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.6 mm-40 -58.54 -34.29 70.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.53 1.132 . . . . 0.0 111.165 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -52.71 64.54 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 122.501 1.143 . . . . 0.0 109.023 175.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -67.82 -33.3 74.52 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.806 0.843 . . . . 0.0 109.851 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -63.23 -29.9 71.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.578 172.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -76.52 -45.11 32.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.289 1.404 . . . . 0.0 108.843 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.559 HG21 ' CD1' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -61.94 -49.33 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.631 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 36.8 tpp -63.81 -34.8 78.72 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.54 -177.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.04 -41.03 82.4 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 119.061 0.846 . . . . 0.0 111.212 174.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -35.78 78.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.768 0.427 . . . . 0.0 111.178 175.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.99 -13.06 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.088 178.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 52' ' ' GLU . 3.4 t-80 -60.01 -30.41 69.13 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -152.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -62.25 -21.09 64.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.12 0.873 . . . . 0.0 112.268 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -96.46 -1.66 46.94 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.629 1.572 . . . . 0.0 110.924 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 49' ' ' HIS . 46.1 mm-40 -135.61 -15.74 1.83 Allowed 'General case' 0 C--N 1.338 0.092 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -158.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.58 -10.22 4.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.298 1.039 . . . . 0.0 113.293 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -117.46 13.76 14.49 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.88 2.072 . . . . 0.0 111.365 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.59 -22.99 1.65 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.924 1.29 . . . . 0.0 113.074 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -70.81 -4.29 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 120.638 1.563 . . . . 0.0 113.728 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -55.23 -20.62 11.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.517 1.527 . . . . 0.0 114.021 159.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -93.32 -173.39 40.24 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.637 1.113 . . . . 0.0 112.661 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -68.55 173.18 10.23 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.584 2.856 . . . . 0.0 111.08 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.1 mt -146.22 149.96 34.91 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.636 1.175 . . . . 0.0 108.431 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -147.7 148.01 30.56 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.165 1.386 . . . . 0.0 108.012 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 2.4 mm -135.51 149.4 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -138.82 143.5 38.9 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 161.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.4 p -147.76 157.06 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 O-C-N 120.405 -1.435 . . . . 0.0 109.876 -168.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -149.78 150.98 32.83 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 167.071 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.66 145.27 29.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 164.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -126.23 -179.8 4.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.779 2.432 . . . . 0.0 107.858 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.08 -32.26 71.91 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -166.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.505 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.0 mmtm -140.64 23.08 2.31 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.214 1.005 . . . . 0.0 112.227 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.16 -170.24 38.62 Favored Glycine 0 C--N 1.332 0.325 0 O-C-N 120.917 -1.114 . . . . 0.0 110.895 -173.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.6 mp -131.06 148.15 52.71 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.744 1.617 . . . . 0.0 107.297 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -105.38 136.12 45.5 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 158.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -127.05 120.36 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 105.007 -2.22 . . . . 0.0 105.007 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -102.61 143.65 14.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 104.634 -2.358 . . . . 0.0 104.634 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.15 141.05 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 172.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -135.92 164.2 28.51 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.361 0.664 . . . . 0.0 109.676 -165.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.288 0 C-N-CA 125.655 1.582 . . . . 0.0 108.158 172.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptm . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -127.55 79.61 1.9 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -152.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 mm -75.06 152.07 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 124.732 1.213 . . . . 0.0 109.804 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -141.95 148.35 38.49 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.579 1.952 . . . . 0.0 108.508 167.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.37 102.53 9.01 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.2 mm -70.93 -56.03 12.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 -170.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -162.61 -171.37 2.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.792 1.637 . . . . 0.0 108.84 -177.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.28 -6.12 8.91 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -118.91 -31.06 4.88 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.937 1.295 . . . . 0.0 111.601 -169.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.0 m -129.5 140.18 51.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.465 1.106 . . . . 0.0 109.278 -170.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.69 155.53 41.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 166.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -136.85 167.79 20.8 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.425 ' CE1' HG21 ' A' ' 44' ' ' VAL . 34.1 p90 -155.49 164.13 39.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.608 0.718 . . . . 0.0 109.351 172.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -114.93 142.61 46.36 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -136.43 115.53 12.42 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -72.77 158.66 35.15 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -53.61 -42.19 67.44 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 121.784 -0.573 . . . . 0.0 111.423 171.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.84 -27.05 69.51 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.167 -0.796 . . . . 0.0 113.043 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.92 -31.48 69.28 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.446 1.623 . . . . 0.0 110.778 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.8 mt -79.0 -43.97 24.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.837 1.255 . . . . 0.0 107.796 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -58.68 -40.71 84.36 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.289 1.436 . . . . 0.0 111.861 173.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.37 -44.62 95.44 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.165 0.986 . . . . 0.0 111.47 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -69.52 -6.88 33.63 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.578 173.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 12.91 84.16 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.465 1.031 . . . . 0.0 113.07 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -82.28 -174.28 5.04 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.419 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 7.7 t70 -137.35 144.65 42.64 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -55.63 -35.49 65.97 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.249 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -76.74 -44.49 33.01 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 118.708 0.686 . . . . 0.0 109.611 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.419 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.02 -37.7 83.49 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 121.389 -0.819 . . . . 0.0 111.311 -173.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -54.2 -45.82 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.78 0.832 . . . . 0.0 109.909 171.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -68.37 -22.2 64.67 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.452 1.024 . . . . 0.0 113.14 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -121.9 3.81 9.97 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -160.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -137.75 82.22 1.91 Allowed 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -178.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -46.28 -43.36 15.65 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.191 0.996 . . . . 0.0 113.654 -166.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.23 -32.21 64.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.684 -0.635 . . . . 0.0 111.683 -177.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -77.78 -20.39 53.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.647 -0.692 . . . . 0.0 110.968 174.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -52.72 62.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 166.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -52.59 -34.1 49.25 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.681 1.592 . . . . 0.0 113.311 -168.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -55.74 -36.32 67.13 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.979 1.311 . . . . 0.0 111.51 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -57.69 11.94 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.437 1.095 . . . . 0.0 108.829 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -62.6 -35.5 79.73 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.962 1.305 . . . . 0.0 110.033 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -62.87 -39.37 94.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.114 171.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -68.35 -41.88 80.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.31 1.414 . . . . 0.0 110.232 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.425 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -68.72 -42.25 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 121.331 -0.856 . . . . 0.0 111.458 -178.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.9 mmt -54.5 -48.58 71.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.177 0.591 . . . . 0.0 109.674 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.74 -41.32 90.71 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 122.521 0.329 . . . . 0.0 111.498 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -65.53 -12.54 53.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.195 1.798 . . . . 0.0 112.488 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.64 1.16 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.266 1.026 . . . . 0.0 111.778 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.55 -20.82 65.05 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -163.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.04 -20.84 60.01 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.403 1.001 . . . . 0.0 112.13 173.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -103.72 5.96 36.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.138 1.375 . . . . 0.0 111.144 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.16 -20.95 4.74 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.806 1.243 . . . . 0.0 111.93 -173.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.51 -18.58 59.73 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.277 1.031 . . . . 0.0 113.768 -173.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -102.88 3.57 36.7 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.272 1.429 . . . . 0.0 111.761 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.71 40.91 1.3 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.123 1.769 . . . . 0.0 109.869 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.94 66.61 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -153.89 37.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 113.513 -1.676 . . . . 0.0 108.86 -168.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.9 -175.31 35.53 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 126.099 1.809 . . . . 0.0 109.906 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.44 172.27 12.63 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.5 2.8 . . . . 0.0 111.465 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 35.6 mt -135.65 154.18 51.39 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.219 1.408 . . . . 0.0 107.955 171.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.9 m95 -149.2 145.7 27.26 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 125.245 1.418 . . . . 0.0 107.519 -164.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -134.82 143.71 36.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -175.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -137.6 147.44 45.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.083 1.753 . . . . 0.0 106.67 165.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.1 p -150.39 155.66 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 120.647 -1.283 . . . . 0.0 109.719 -170.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -148.95 150.63 33.2 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 164.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.19 146.16 26.12 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 167.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.32 -177.49 4.09 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.779 2.432 . . . . 0.0 108.045 177.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.51 -33.8 73.16 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -139.6 23.6 2.48 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.464 1.106 . . . . 0.0 112.607 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -179.53 -165.26 33.34 Favored Glycine 0 CA--C 1.521 0.444 0 O-C-N 121.11 -0.994 . . . . 0.0 111.624 -173.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 mp -132.48 148.55 52.4 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.939 1.696 . . . . 0.0 108.041 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -103.33 138.62 39.84 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 156.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.414 HD13 ' CE2' ' A' ' 13' ' ' PHE . 1.1 mp -127.2 129.14 70.89 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.026 0 N-CA-C 104.92 -2.252 . . . . 0.0 104.92 -178.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -112.17 141.98 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 170.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.0 m -135.9 138.39 47.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 121.243 -0.911 . . . . 0.0 108.549 171.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -133.75 166.87 21.63 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.169 0.588 . . . . 0.0 110.726 -160.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt . . . . . 0 C--O 1.234 0.274 0 C-N-CA 126.164 1.786 . . . . 0.0 110.241 167.625 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -146.03 136.95 24.46 Favored 'General case' 0 C--O 1.224 -0.274 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 -164.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.05 150.73 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 120.589 1.54 . . . . 0.0 107.95 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.88 151.91 41.56 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.699 1.2 . . . . 0.0 111.013 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 tpp85 -117.68 87.15 2.65 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.651 1.98 . . . . 0.0 106.105 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -57.1 -53.38 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.78 0.8 . . . . 0.0 109.166 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -152.85 -165.93 2.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.009 2.124 . . . . 0.0 106.32 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -78.25 0.41 25.35 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -128.97 -47.74 1.23 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.042 0.937 . . . . 0.0 111.931 -172.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 60.5 m -81.99 135.55 35.35 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 170.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.05 157.69 41.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 165.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -136.31 167.54 21.12 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 168.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CE1' HG21 ' A' ' 44' ' ' VAL . 48.7 p90 -149.2 165.35 32.13 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 175.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -127.53 128.74 46.17 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 3.7 ttt -123.78 117.0 23.91 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.928 1.291 . . . . 0.0 108.28 -170.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.6 m -78.09 153.54 32.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.4 m-85 -58.36 -36.45 73.49 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.329 -0.857 . . . . 0.0 112.171 176.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.94 -29.8 75.76 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-O 119.456 -0.636 . . . . 0.0 112.238 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.47 -37.28 74.25 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.86 1.33 . . . . 0.0 110.474 177.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 33.0 mt -67.1 -48.84 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.803 1.241 . . . . 0.0 109.266 178.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -58.65 -38.98 79.29 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 125.467 1.507 . . . . 0.0 110.954 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.99 -41.12 91.51 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.989 0.899 . . . . 0.0 110.629 -175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.1 mtt85 -67.76 -9.19 41.85 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.174 1.39 . . . . 0.0 111.865 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.3 11.13 82.66 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.692 1.139 . . . . 0.0 113.014 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -86.38 -174.64 5.13 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 166.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -141.33 153.64 45.24 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.112 -0.992 . . . . 0.0 108.344 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -64.73 -28.5 69.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -167.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -87.19 -44.68 11.3 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -57.32 -35.77 70.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 112.95 -171.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.23 -55.8 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.895 1.278 . . . . 0.0 109.344 168.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -76.63 -14.16 60.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -119.87 6.52 10.9 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.899 0.88 . . . . 0.0 112.517 -167.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -129.0 86.22 2.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 170.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -52.27 -35.1 49.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -163.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -31.83 40.58 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.09 0.556 . . . . 0.0 111.672 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -79.94 -16.32 55.51 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.175 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.16 -50.58 72.6 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 167.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -54.62 -31.99 58.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -168.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.3 mm-40 -59.19 -36.23 74.98 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.016 1.326 . . . . 0.0 111.228 -177.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -57.84 10.94 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.32 1.048 . . . . 0.0 108.701 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -63.03 -34.19 77.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.153 0.981 . . . . 0.0 110.454 -173.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -62.88 -35.89 81.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.503 -0.76 . . . . 0.0 112.516 173.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.98 -43.71 70.91 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 120.091 1.314 . . . . 0.0 110.522 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.445 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.98 -37.99 70.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 O-C-N 121.163 -0.96 . . . . 0.0 111.526 -178.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 19.5 tpp -62.74 -39.72 94.99 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.064 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -57.84 -38.61 75.96 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 120.171 1.35 . . . . 0.0 111.561 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.92 -9.96 2.18 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.658 1.583 . . . . 0.0 113.541 173.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.2 t -129.27 -9.25 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 126.3 1.84 . . . . 0.0 110.54 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.03 -28.25 69.96 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.843 -1.161 . . . . 0.0 113.984 -157.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -60.7 -16.09 35.77 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.745 0.702 . . . . 0.0 112.396 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -114.14 6.79 16.44 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.167 1.787 . . . . 0.0 110.803 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -132.73 -18.33 2.43 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.886 1.274 . . . . 0.0 112.557 -172.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.9 -23.17 60.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.567 1.076 . . . . 0.0 112.993 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -98.75 5.6 47.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.8 1.64 . . . . 0.0 111.82 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.17 -15.72 2.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.067 1.347 . . . . 0.0 112.927 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.75 3.04 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 120.282 1.401 . . . . 0.0 113.697 173.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -57.16 -19.7 21.96 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.241 1.017 . . . . 0.0 113.077 155.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -107.97 -177.84 22.18 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.233 1.397 . . . . 0.0 111.762 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.02 170.16 19.6 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.614 2.876 . . . . 0.0 112.803 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.6 tp -144.32 153.76 42.33 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.121 1.768 . . . . 0.0 106.499 169.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -142.0 151.6 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.679 1.592 . . . . 0.0 107.05 -173.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.449 HG23 HG12 ' A' ' 75' ' ' VAL . 4.3 mm -139.27 139.22 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -170.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.22 167.53 22.2 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.793 1.237 . . . . 0.0 109.439 161.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.1 p -144.23 160.16 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.503 0.721 . . . . 0.0 109.864 -169.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -131.31 146.23 52.21 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 127.088 2.155 . . . . 0.0 105.574 163.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.66 129.92 55.34 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 167.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.405 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -118.7 -169.97 1.82 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 127.083 2.153 . . . . 0.0 108.272 -169.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.24 -43.2 96.28 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.9 mmtp -142.09 25.3 1.93 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.705 1.202 . . . . 0.0 112.367 -177.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -174.49 -170.52 37.78 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mp -135.53 143.54 45.8 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.889 1.276 . . . . 0.0 108.454 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.405 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.4 mt-10 -93.14 141.23 28.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 161.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -127.88 128.4 69.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -117.13 134.59 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 103.955 -2.609 . . . . 0.0 103.955 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.449 HG12 HG23 ' A' ' 62' ' ' ILE . 9.6 m -132.55 134.96 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.2 p -132.34 174.75 9.91 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.682 0.793 . . . . 0.0 110.573 -155.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.3 mttt . . . . . 0 C--N 1.341 0.237 0 C-N-CA 124.714 1.205 . . . . 0.0 111.566 171.89 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ptm . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -130.02 130.22 44.68 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.457 1.503 . . . . 0.0 106.988 -169.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -122.63 153.1 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.967 1.258 . . . . 0.0 108.93 -171.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -142.18 151.73 42.48 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.931 1.292 . . . . 0.0 110.797 173.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -113.88 90.21 3.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.22 1.808 . . . . 0.0 106.504 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.5 mm -58.84 -53.03 53.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.981 0.896 . . . . 0.0 109.03 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -152.58 -166.97 2.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.488 2.315 . . . . 0.0 105.54 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -77.44 1.34 19.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.814 -1.179 . . . . 0.0 113.868 -173.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -129.94 -50.5 1.13 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.436 1.094 . . . . 0.0 111.116 -168.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 76.8 m -82.25 137.55 34.84 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.7 m -128.57 157.72 41.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.855 -1.906 . . . . 0.0 105.855 165.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -133.28 166.98 21.23 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 166.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.0 162.95 39.37 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -124.9 139.62 53.67 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.1 ttt -138.89 103.27 4.76 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -167.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.2 m -64.22 149.79 47.21 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.427 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.8 m-85 -55.13 -32.65 62.22 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -81.36 -11.66 83.05 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.573 -1.126 . . . . 0.0 113.426 -178.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.27 -42.96 82.98 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 120.169 1.984 . . . . 0.0 108.916 167.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -64.08 -45.4 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.13 1.372 . . . . 0.0 108.998 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 122.508 0.323 . . . . 0.0 111.531 -176.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.33 -40.64 97.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.718 0.771 . . . . 0.0 111.251 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtt-85 -65.9 -14.59 61.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 114.86 -1.063 . . . . 0.0 110.925 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.63 9.67 80.87 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 124.959 1.266 . . . . 0.0 112.762 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -83.61 -178.38 7.01 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 171.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -134.24 147.61 50.71 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -58.41 -31.1 67.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.431 -176.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -83.38 -47.14 11.76 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 173.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.05 -35.95 69.95 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.727 0.811 . . . . 0.0 112.522 -172.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -43.9 -55.82 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.465 1.106 . . . . 0.0 109.386 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -75.49 -16.26 60.32 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -172.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -116.92 7.7 13.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.748 0.819 . . . . 0.0 112.68 -166.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -136.51 88.9 2.41 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -48.95 -45.38 41.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -70.73 -30.79 67.41 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.617 -0.677 . . . . 0.0 111.007 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -78.42 -20.66 50.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.765 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.71 -49.3 71.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 167.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -53.49 -34.82 59.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.965 1.306 . . . . 0.0 112.68 -169.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.413 ' H ' ' HG2' ' A' ' 39' ' ' GLU . 1.9 mm-40 -58.19 -33.96 69.84 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.719 1.208 . . . . 0.0 111.389 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -54.07 51.02 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HA ' HG22 ' A' ' 44' ' ' VAL . 73.9 m-85 -67.15 -36.59 82.17 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.029 0.932 . . . . 0.0 110.263 -173.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 m95 -57.37 -36.48 71.29 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.153 -0.927 . . . . 0.0 112.167 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -68.63 -42.48 77.98 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.464 1.484 . . . . 0.0 111.085 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' A' ' 41' ' ' PHE . 13.5 m -75.19 -38.33 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 120.935 -1.103 . . . . 0.0 111.477 -175.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.8 mmt -59.98 -42.76 94.86 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.935 -0.555 . . . . 0.0 109.954 168.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.87 -41.25 82.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.045 0.839 . . . . 0.0 111.532 176.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -59.61 -9.34 2.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.373 1.869 . . . . 0.0 112.806 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -123.81 -8.33 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.25 1.82 . . . . 0.0 110.059 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -58.91 -28.08 65.86 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -163.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.38 -15.04 62.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.482 1.037 . . . . 0.0 112.462 177.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -112.3 -40.85 4.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.812 1.645 . . . . 0.0 109.236 174.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.73 -26.1 65.37 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.51 1.124 . . . . 0.0 112.118 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -57.5 -24.03 53.54 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.079 1.309 . . . . 0.0 112.569 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -78.83 -14.04 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.736 0.815 . . . . 0.0 112.09 176.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.21 8.57 2.47 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -164.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.16 69.1 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.936 1.35 . . . . 0.0 109.759 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -156.88 30.46 0.31 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.757 1.223 . . . . 0.0 110.088 -172.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 -179.88 37.84 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.373 0.987 . . . . 0.0 111.117 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.58 172.06 15.07 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.903 3.069 . . . . 0.0 112.317 -174.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 25.6 tp -135.93 154.32 51.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.404 1.482 . . . . 0.0 107.154 169.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -143.35 149.69 38.1 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.628 1.571 . . . . 0.0 107.256 -171.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mm -134.81 144.07 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.253 0.933 . . . . 0.0 109.728 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -138.57 150.54 46.43 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.638 1.975 . . . . 0.0 107.073 165.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.12 158.35 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.092 -1.005 . . . . 0.0 109.077 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.75 151.82 43.23 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 157.261 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.63 145.1 26.62 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 mp -124.27 -172.46 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.762 2.825 . . . . 0.0 107.714 -174.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.38 -37.84 84.87 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -167.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.7 mmtm -140.97 25.43 2.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.337 1.055 . . . . 0.0 112.569 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.76 -168.82 37.29 Favored Glycine 0 C--O 1.228 -0.255 0 O-C-N 120.98 -1.075 . . . . 0.0 110.551 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mp -135.01 145.34 47.99 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.729 1.211 . . . . 0.0 108.98 177.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -97.98 128.53 44.6 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 162.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.08 128.77 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.58 142.05 23.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 173.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.53 136.71 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 171.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.4 p -128.21 174.57 9.16 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.179 0.992 . . . . 0.0 110.113 -160.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 70.1 mttt . . . . . 0 CA--C 1.529 0.167 0 C-N-CA 124.969 1.308 . . . . 0.0 110.173 170.698 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptm . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 120.297 0.094 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -133.67 127.89 33.86 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 -170.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.1 mm -125.64 151.05 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.583 1.553 . . . . 0.0 107.957 -174.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -146.0 151.03 37.11 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.345 1.058 . . . . 0.0 110.885 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -112.4 101.98 10.14 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.333 1.853 . . . . 0.0 106.29 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.3 mm -70.17 -55.93 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -177.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -159.22 -170.5 3.01 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.141 1.376 . . . . 0.0 109.702 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.85 -15.74 5.35 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.206 1.403 . . . . 0.0 114.07 -175.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -124.72 -40.77 2.17 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.976 0.911 . . . . 0.0 111.468 -171.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -98.62 139.36 34.44 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 122.161 0.982 . . . . 0.0 109.305 -173.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -124.05 162.12 25.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 165.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.7 pttt -135.02 168.56 18.9 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.577 -0.702 . . . . 0.0 109.395 160.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 44' ' ' VAL . 45.6 p90 -146.44 168.97 19.85 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -132.33 140.0 48.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -135.28 114.47 12.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -170.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -74.52 154.87 38.47 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.486 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-30 -53.98 -32.14 53.03 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 175.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -90.02 -8.05 67.39 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.257 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -47.65 69.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.973 1.886 . . . . 0.0 107.755 162.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.1 mt -56.85 -47.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.179 1.392 . . . . 0.0 108.546 176.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.96 -36.75 80.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 117.971 0.351 . . . . 0.0 111.74 -176.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -64.12 -41.17 97.34 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.58 0.705 . . . . 0.0 110.581 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.34 -4.02 23.84 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.771 1.228 . . . . 0.0 111.153 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.73 7.82 86.83 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.958 1.266 . . . . 0.0 112.634 173.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -84.18 -172.27 4.07 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 168.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -146.09 152.89 40.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -59.07 -33.27 70.6 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 120.168 1.349 . . . . 0.0 111.913 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.12 -48.14 21.77 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -63.16 -33.99 76.66 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 123.507 0.723 . . . . 0.0 112.51 -170.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.86 -56.74 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.036 0.934 . . . . 0.0 108.539 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -77.17 -33.85 56.46 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 121.849 -0.532 . . . . 0.0 111.57 -171.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -89.46 4.44 49.12 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.229 0.611 . . . . 0.0 111.866 -166.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -139.1 88.6 2.29 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -51.45 -38.94 56.21 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -30.57 59.2 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.586 -0.696 . . . . 0.0 111.189 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -80.56 -15.66 56.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.27 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -51.76 66.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 166.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -55.91 -31.13 62.59 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.546 1.538 . . . . 0.0 112.554 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.93 -38.66 76.32 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.897 1.279 . . . . 0.0 111.543 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.421 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -59.54 -51.01 71.7 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.755 0.822 . . . . 0.0 109.223 176.668 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -65.24 -38.95 91.96 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.622 0.769 . . . . 0.0 110.41 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -60.46 -38.5 84.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 118.781 -0.628 . . . . 0.0 111.556 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -74.4 -33.98 63.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.708 1.14 . . . . 0.0 110.79 -174.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 13' ' ' PHE . 17.8 m -72.67 -43.04 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 119.295 0.952 . . . . 0.0 111.635 175.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.0 mmt -55.05 -45.44 75.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.081 0.552 . . . . 0.0 109.61 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.38 -43.81 92.84 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.451 0.3 . . . . 0.0 111.697 176.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -63.95 -13.24 44.44 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.26 1.424 . . . . 0.0 112.491 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 m -120.84 3.18 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.339 1.056 . . . . 0.0 111.586 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -18.84 63.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -164.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.5 -23.47 65.93 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.351 0.978 . . . . 0.0 111.657 173.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -89.2 -8.13 54.21 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.447 1.099 . . . . 0.0 111.21 175.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -124.15 -18.8 5.77 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.418 1.087 . . . . 0.0 112.327 -162.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.68 -26.16 61.29 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.625 1.102 . . . . 0.0 112.179 177.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -83.73 -7.49 59.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.588 1.155 . . . . 0.0 112.651 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.3 7.92 2.0 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.561 1.144 . . . . 0.0 113.515 -166.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.263 7.6 p -79.04 71.1 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 123.077 1.418 . . . . 0.0 109.374 175.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -161.66 37.77 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.89 1.676 . . . . 0.0 108.972 -172.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.31 -173.56 22.69 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.919 1.247 . . . . 0.0 111.188 -173.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.44 179.58 4.96 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.518 2.812 . . . . 0.0 111.311 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.78 135.62 22.28 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -141.95 149.6 40.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.42 1.088 . . . . 0.0 109.084 -171.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.4 mm -132.59 145.91 33.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.896 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -138.71 92.29 2.61 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.412 1.485 . . . . 0.0 107.541 160.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.54 153.95 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.665 0.786 . . . . 0.0 108.884 166.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 152.13 34.07 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 152.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.38 143.36 32.78 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.672 0.789 . . . . 0.0 110.09 -175.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.52 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -130.12 -178.82 4.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.997 2.519 . . . . 0.0 107.914 -173.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.41 -35.04 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -164.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.486 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.1 mmtm -141.94 27.03 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.44 1.096 . . . . 0.0 112.353 178.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.89 -172.46 42.37 Favored Glycine 0 CA--C 1.519 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 110.801 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -136.72 139.45 41.92 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.515 1.126 . . . . 0.0 109.387 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.52 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 15.1 mt-10 -90.89 143.46 26.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 162.647 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.43 118.9 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.75 146.93 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 168.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.32 119.29 14.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 -174.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -121.02 165.16 15.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.637 0.653 . . . . 0.0 110.057 -163.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.35 0 C-N-CA 125.76 1.624 . . . . 0.0 108.655 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 ptm . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -124.26 77.56 1.57 Allowed 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -158.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 mm -69.61 152.68 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.174 1.39 . . . . 0.0 110.422 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -140.19 149.95 43.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.069 1.747 . . . . 0.0 109.674 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -109.24 107.62 17.93 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.0 mm -73.64 -55.53 12.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.1 p30 -163.34 -175.76 4.42 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.297 1.839 . . . . 0.0 107.373 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.3 -24.32 59.18 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.381 -1.45 . . . . 0.0 113.04 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -102.3 -25.75 13.55 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.944 0.897 . . . . 0.0 111.851 -169.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 75.6 m -128.04 137.07 52.04 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.247 1.022 . . . . 0.0 108.523 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 m -123.44 156.59 29.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 105.505 -2.035 . . . . 0.0 105.505 166.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 pttt -135.51 168.93 18.33 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 161.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -153.71 161.1 42.42 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -110.67 143.98 40.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 166.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -139.45 108.81 6.13 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 152.37 45.48 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.449 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.6 m-85 -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.02 0.528 . . . . 0.0 112.221 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.19 -25.44 69.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.058 -0.857 . . . . 0.0 113.402 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.82 -38.94 80.22 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.301 1.551 . . . . 0.0 109.64 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.2 mt -71.37 -42.27 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 125.016 1.326 . . . . 0.0 108.319 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.27 -39.55 90.8 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.787 1.235 . . . . 0.0 111.458 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -62.96 -42.1 99.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.624 0.726 . . . . 0.0 111.132 -177.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.8 mtt-85 -68.43 -11.52 59.82 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.221 173.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.55 12.34 84.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.613 1.102 . . . . 0.0 113.243 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -82.73 -175.07 5.6 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 167.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -137.2 152.83 50.32 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 170.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.8 ptt-85 -59.04 -27.69 65.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.797 1.239 . . . . 0.0 113.259 -175.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -91.52 -43.75 9.49 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.65 -34.16 70.9 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 124.245 1.018 . . . . 0.0 112.314 -174.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -44.17 -56.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 124.474 1.11 . . . . 0.0 109.128 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -74.62 -34.44 62.8 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.118 0.567 . . . . 0.0 112.06 -172.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -94.14 7.68 44.35 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -168.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -134.73 89.94 2.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -52.38 -37.42 56.29 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -164.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -32.43 58.92 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.775 0.43 . . . . 0.0 111.704 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -76.66 -20.05 57.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.898 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.3 -50.84 70.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 168.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -35.01 62.21 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.92 1.288 . . . . 0.0 112.781 -169.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -58.12 -34.92 70.75 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.371 1.068 . . . . 0.0 111.193 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -54.8 42.62 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.074 0.95 . . . . 0.0 108.707 174.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.401 ' HA ' HG22 ' A' ' 44' ' ' VAL . 78.5 m-85 -64.85 -38.1 89.85 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.115 0.966 . . . . 0.0 110.181 -174.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -60.74 -37.8 83.0 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.344 -0.836 . . . . 0.0 112.584 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.54 -38.39 80.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 120.363 1.438 . . . . 0.0 111.513 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.401 HG22 ' HA ' ' A' ' 41' ' ' PHE . 18.9 m -74.04 -42.01 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 121.008 -1.057 . . . . 0.0 111.677 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.04 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.856 0.462 . . . . 0.0 109.959 168.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.19 -38.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 118.06 0.391 . . . . 0.0 111.788 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.16 -13.14 15.69 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.653 1.181 . . . . 0.0 112.993 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.96 16.05 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 124.98 1.312 . . . . 0.0 111.691 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -23.99 67.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.409 -0.807 . . . . 0.0 112.328 -169.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.53 -25.82 67.54 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -91.45 -44.92 8.83 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.54 0.736 . . . . 0.0 109.261 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -64.97 -26.78 68.44 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 118.314 -0.851 . . . . 0.0 112.187 -172.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -61.31 -9.85 5.96 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 120.338 1.426 . . . . 0.0 112.785 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.68 -0.77 11.74 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.578 1.551 . . . . 0.0 111.9 173.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.97 3.87 1.25 Allowed 'General case' 0 C--N 1.342 0.254 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -166.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.267 7.9 p -81.32 57.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 120.254 1.388 . . . . 0.0 109.664 173.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -83.6 12.59 5.54 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.47 1.108 . . . . 0.0 112.361 -166.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.95 177.34 42.79 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.65 1.119 . . . . 0.0 110.635 -177.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.42 167.53 26.08 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.001 3.134 . . . . 0.0 111.017 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.91 147.98 49.56 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.42 0.629 . . . . 0.0 109.433 171.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -147.79 142.43 26.59 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 128.286 2.634 . . . . 0.0 104.296 173.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.572 HD12 ' N ' ' A' ' 63' ' ' GLN . 0.5 OUTLIER -144.15 152.55 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 120.309 1.413 . . . . 0.0 110.742 -175.225 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.572 ' N ' HD12 ' A' ' 62' ' ' ILE . 46.0 tt0 -137.83 148.93 45.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.384 1.874 . . . . 0.0 106.697 170.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 p -141.42 160.2 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 O-C-N 120.46 -1.4 . . . . 0.0 109.459 -176.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -142.72 152.19 42.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 158.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.46 141.68 34.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -124.58 -174.84 3.12 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.927 2.491 . . . . 0.0 107.831 -172.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.29 -37.93 82.05 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -166.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 75.1 mmtt -140.45 25.67 2.2 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.339 1.056 . . . . 0.0 111.673 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.53 -170.4 39.08 Favored Glycine 0 C--O 1.227 -0.321 0 O-C-N 121.101 -1.0 . . . . 0.0 110.972 -174.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.16 146.27 44.75 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.803 1.241 . . . . 0.0 108.848 177.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -97.47 129.42 44.66 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 161.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.479 HG23 HD13 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -117.57 128.46 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 105.183 -2.154 . . . . 0.0 105.183 179.718 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -103.56 145.16 13.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 169.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.03 134.87 42.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.5 p -134.02 175.9 9.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.677 0.791 . . . . 0.0 109.82 -164.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.8 mppt? . . . . . 0 CA--C 1.533 0.318 0 C-N-CA 125.517 1.527 . . . . 0.0 108.644 171.985 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -139.78 78.72 1.68 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -145.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 mm -67.6 153.69 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 124.142 0.977 . . . . 0.0 109.404 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.92 152.65 42.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.731 1.613 . . . . 0.0 110.303 172.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.5 tpp85 -114.69 90.95 3.46 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.912 1.685 . . . . 0.0 106.758 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.42 -53.23 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 122.023 0.916 . . . . 0.0 109.019 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -151.45 -168.76 3.18 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.597 2.359 . . . . 0.0 105.558 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -77.84 5.18 10.1 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.084 -1.01 . . . . 0.0 113.69 -172.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -130.68 -55.14 1.07 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.289 1.036 . . . . 0.0 110.682 -171.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -77.38 138.6 39.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 171.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -125.36 160.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 166.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.2 pttt -134.29 168.95 17.95 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 160.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.0 142.42 25.23 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 170.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -94.05 137.94 32.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 165.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.4 ttt -131.24 116.71 18.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -174.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -76.27 154.06 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.405 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -56.66 -39.06 73.08 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.524 -0.735 . . . . 0.0 112.209 177.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.54 -24.61 73.88 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.763 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -28.63 64.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.083 1.442 . . . . 0.0 110.627 174.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.54 -43.45 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.825 1.25 . . . . 0.0 107.661 178.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.17 -39.58 82.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.565 1.146 . . . . 0.0 111.327 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.13 -45.25 92.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.247 1.019 . . . . 0.0 111.276 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.7 mtt85 -69.03 -6.89 30.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.341 1.056 . . . . 0.0 111.527 172.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.65 12.91 84.03 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.547 1.07 . . . . 0.0 113.194 176.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.69 -174.06 4.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 167.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -139.05 149.69 44.9 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.1 ptt180 -62.38 -31.4 72.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -168.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.54 -44.1 12.95 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 173.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.62 -35.92 68.85 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.309 1.044 . . . . 0.0 112.69 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.1 mm -43.51 -50.98 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 124.791 1.236 . . . . 0.0 110.683 169.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.4 m95 -80.22 -12.95 59.58 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.259 1.024 . . . . 0.0 113.55 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -123.03 7.28 9.24 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -166.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -124.98 99.41 6.12 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 172.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 46.2 ptt85 -60.27 -14.29 17.26 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -163.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -30.37 7.32 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.563 1.545 . . . . 0.0 111.891 178.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -79.53 -14.96 58.51 Favored 'General case' 0 C--N 1.339 0.151 0 O-C-N 121.3 -0.875 . . . . 0.0 111.322 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.5 p -52.19 -57.5 9.45 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.171 0.989 . . . . 0.0 109.533 163.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.48 -32.06 64.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.232 1.813 . . . . 0.0 112.522 -167.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.2 mm-40 -60.01 -34.8 73.84 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.661 1.185 . . . . 0.0 111.219 -176.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -51.94 67.76 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 174.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -66.18 -38.43 88.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.429 0.691 . . . . 0.0 109.924 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -58.34 -37.55 75.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.627 -0.702 . . . . 0.0 112.097 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -64.39 -39.68 94.32 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.022 1.283 . . . . 0.0 111.134 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.8 m -82.47 -39.39 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 O-C-N 121.086 -1.009 . . . . 0.0 112.33 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 mmt -53.14 -47.07 69.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.408 0.683 . . . . 0.0 109.422 166.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.84 -42.0 78.89 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.575 0.625 . . . . 0.0 111.84 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -59.73 -14.86 16.15 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.082 1.353 . . . . 0.0 113.08 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 m -129.76 2.75 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 C-N-CA 124.396 1.078 . . . . 0.0 111.976 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -24.32 67.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -162.143 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.82 -15.94 35.54 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.66 0.664 . . . . 0.0 112.115 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -113.38 3.14 15.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.868 1.667 . . . . 0.0 110.957 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -115.18 -21.34 10.0 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.228 1.411 . . . . 0.0 111.346 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.31 -15.84 18.38 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -176.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -112.67 6.48 18.26 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.003 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -136.37 0.92 2.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.157 1.383 . . . . 0.0 113.217 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -78.29 73.17 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 122.947 1.356 . . . . 0.0 109.415 172.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -153.64 32.42 0.45 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.012 1.325 . . . . 0.0 109.555 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.13 -178.16 35.78 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.084 1.326 . . . . 0.0 110.84 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -71.91 171.15 17.19 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.7 2.933 . . . . 0.0 112.197 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.93 152.08 46.08 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.588 1.555 . . . . 0.0 107.121 171.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -144.11 150.51 38.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.96 1.304 . . . . 0.0 107.683 -168.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mm -135.0 144.72 33.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -172.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.63 170.59 15.56 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 148.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.27 159.6 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.513 -0.742 . . . . 0.0 110.702 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -129.18 145.37 51.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.751 2.42 . . . . 0.0 105.409 167.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.42 132.0 54.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 168.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.14 -169.81 1.86 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.415 2.286 . . . . 0.0 108.496 -170.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.87 -41.84 98.34 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -169.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.0 mmtp -140.11 22.9 2.41 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.697 1.199 . . . . 0.0 112.445 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.19 -168.44 36.38 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mp -135.62 146.77 48.23 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.462 1.505 . . . . 0.0 108.725 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -100.83 122.67 43.81 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 164.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.73 127.25 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -109.93 142.1 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.17 115.14 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -170.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -117.24 171.04 8.22 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.582 0.628 . . . . 0.0 110.435 -163.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 68.8 mttt . . . . . 0 C--O 1.233 0.226 0 C-N-CA 125.237 1.415 . . . . 0.0 109.768 170.003 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.977 0.418 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -127.49 74.97 1.56 Allowed 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 -149.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 mm -69.29 152.56 9.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.106 1.362 . . . . 0.0 110.167 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.64 152.42 45.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.437 1.895 . . . . 0.0 109.869 172.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.9 tpp85 -118.29 91.61 3.61 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.178 1.791 . . . . 0.0 106.185 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.33 -53.38 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.4 p30 -156.92 -166.88 2.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.787 2.035 . . . . 0.0 106.54 175.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.17 2.58 23.68 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.748 -1.22 . . . . 0.0 113.886 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -129.66 -29.2 2.18 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.164 1.386 . . . . 0.0 111.894 -169.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 62.9 m -111.53 133.07 54.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.526 1.53 . . . . 0.0 107.849 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.7 m -122.65 159.25 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 165.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -139.26 172.19 13.18 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 161.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 35.9 p90 -150.49 169.81 20.6 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 169.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -122.5 144.23 49.21 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 167.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -137.48 114.89 11.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 -173.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.24 158.08 35.87 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.3 m-30 -53.01 -39.07 62.87 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.549 -0.72 . . . . 0.0 111.982 172.153 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.31 -25.74 73.58 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.451 -0.638 . . . . 0.0 113.051 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -34.53 76.55 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.979 1.389 . . . . 0.0 110.027 173.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 32.4 mt -76.88 -43.1 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.843 1.257 . . . . 0.0 107.907 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.83 -40.77 80.84 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.075 1.35 . . . . 0.0 111.397 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.31 -43.37 98.99 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.594 0.758 . . . . 0.0 111.312 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.1 mtt85 -70.85 -7.55 46.29 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.46 174.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 13.0 84.08 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.695 1.141 . . . . 0.0 112.952 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -82.41 -175.02 5.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.427 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.3 t70 -140.1 147.43 40.24 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -54.76 -38.06 66.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.232 0.924 . . . . 0.0 111.04 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -75.6 -45.0 40.09 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.427 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.6 mm-40 -61.1 -38.22 85.54 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.319 -0.863 . . . . 0.0 111.331 -173.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -54.95 -45.49 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 123.796 0.839 . . . . 0.0 109.773 171.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -69.03 -22.68 64.03 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.488 1.04 . . . . 0.0 112.974 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -120.46 3.93 10.73 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -161.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -137.79 82.4 1.92 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -47.7 -42.3 24.63 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -166.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -31.59 63.99 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.66 -0.65 . . . . 0.0 111.417 -178.144 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.57 -20.41 54.09 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.96 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -52.08 64.66 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 166.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.8 -32.33 60.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.303 1.441 . . . . 0.0 113.092 -168.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.92 -37.63 69.18 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.539 1.136 . . . . 0.0 111.671 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.458 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -61.32 -50.08 74.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.493 0.717 . . . . 0.0 109.689 177.573 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -65.16 -38.41 90.47 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.531 0.732 . . . . 0.0 109.573 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -59.87 -34.88 73.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.095 171.195 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.8 -40.49 69.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 120.622 1.556 . . . . 0.0 110.529 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.4 m -70.88 -41.26 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.258 -0.901 . . . . 0.0 110.927 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.2 mmt -57.95 -42.67 85.43 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.113 0.565 . . . . 0.0 110.49 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.0 -41.3 97.9 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.757 0.708 . . . . 0.0 111.779 176.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -63.37 -13.19 36.69 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.636 1.574 . . . . 0.0 111.864 174.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.5 t -109.66 -5.08 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.983 1.713 . . . . 0.0 109.655 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -56.43 -31.08 63.59 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -161.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.52 -14.67 58.52 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.225 0.92 . . . . 0.0 112.94 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -114.26 -36.9 4.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.99 1.716 . . . . 0.0 109.923 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.87 -28.02 65.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.699 1.199 . . . . 0.0 111.521 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.21 -24.93 57.86 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.405 1.002 . . . . 0.0 112.609 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -83.14 -9.89 58.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.073 0.949 . . . . 0.0 111.983 177.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -135.49 8.64 3.37 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 0.0 113.149 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.6 p -84.68 61.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 123.269 1.509 . . . . 0.0 109.15 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -156.08 31.69 0.34 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.676 1.19 . . . . 0.0 109.457 -171.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -173.87 -177.35 43.01 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.996 1.76 . . . . 0.0 109.328 -172.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.23 173.29 11.61 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.466 2.778 . . . . 0.0 112.116 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.3 tp -138.23 150.06 46.36 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 170.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -142.98 149.73 38.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.547 1.139 . . . . 0.0 107.974 -170.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mm -134.31 144.76 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -171.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -142.9 151.62 41.21 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 162.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.7 p -145.22 158.63 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.455 -1.403 . . . . 0.0 109.821 -166.155 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -136.32 152.21 50.43 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.58 133.18 49.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 158.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.544 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -123.51 178.26 5.26 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.544 1.938 . . . . 0.0 108.099 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.13 -31.85 70.46 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -165.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.536 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.5 mmtm -140.68 21.81 2.33 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.426 1.09 . . . . 0.0 112.656 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.29 -168.27 36.83 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 120.841 -1.162 . . . . 0.0 111.637 -174.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.7 mp -133.08 138.98 46.91 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.285 1.834 . . . . 0.0 107.4 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.544 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 28.4 mt-10 -94.6 143.95 26.0 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 157.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.6 mt -141.62 121.66 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -107.37 142.6 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.53 129.09 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -134.23 168.5 18.75 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.923 0.783 . . . . 0.0 111.26 -163.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.0 mttm . . . . . 0 C--O 1.236 0.364 0 C-N-CA 126.047 1.739 . . . . 0.0 109.787 168.145 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptm . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 110.851 -0.055 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -132.26 127.88 36.66 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -168.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.8 mm -123.77 151.15 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 125.083 1.353 . . . . 0.0 107.976 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -148.31 130.03 15.08 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.595 0.758 . . . . 0.0 110.827 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -88.45 110.78 21.11 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.433 HD11 ' HG2' ' A' ' 12' ' ' LYS . 27.1 mm -74.47 -58.16 5.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.239 0 N-CA-C 108.488 -0.931 . . . . 0.0 108.488 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -157.62 -173.98 4.65 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.605 1.562 . . . . 0.0 108.787 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -56.38 -14.81 3.23 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -174.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -121.09 -46.69 2.31 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.795 1.238 . . . . 0.0 110.879 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.1 m -94.7 142.3 27.61 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.93 0.872 . . . . 0.0 109.621 -172.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.8 m -126.13 163.72 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 166.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.433 ' HG2' HD11 ' A' ' 6' ' ' ILE . 48.2 pttt -134.04 169.13 17.59 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.496 -0.752 . . . . 0.0 109.243 160.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -147.07 167.09 24.96 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 123.831 0.853 . . . . 0.0 108.699 172.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -132.97 143.58 49.55 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 170.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.3 ttt -141.8 112.02 6.93 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -168.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.91 156.06 40.06 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 175.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -55.33 -40.5 71.26 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.389 -0.819 . . . . 0.0 111.978 176.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.86 -12.98 84.08 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 118.612 -1.105 . . . . 0.0 113.769 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.02 -33.74 76.49 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.858 1.829 . . . . 0.0 109.282 166.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.5 mt -77.81 -40.9 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.96 -37.16 81.43 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.207 0.458 . . . . 0.0 111.584 175.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -64.5 -42.43 95.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.87 0.843 . . . . 0.0 111.182 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.6 mtt85 -70.1 -8.02 46.14 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.37 -1.286 . . . . 0.0 111.386 173.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.09 12.81 84.29 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.492 1.044 . . . . 0.0 112.988 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -83.6 -171.87 3.83 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 165.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -139.61 148.17 42.11 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.5 ptt85 -57.96 -31.05 66.49 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 118.77 -0.633 . . . . 0.0 112.064 -177.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -83.1 -46.07 13.23 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.35 -36.46 68.81 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.811 0.844 . . . . 0.0 112.472 -173.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mm -46.03 -48.97 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.508 1.123 . . . . 0.0 110.342 171.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -80.45 -13.35 59.19 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.939 1.088 . . . . 0.0 113.939 -175.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -122.01 10.87 10.19 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.046 0.839 . . . . 0.0 112.731 -166.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -133.63 99.26 4.43 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -58.75 -15.61 12.91 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -164.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.4 -30.83 7.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.463 1.505 . . . . 0.0 111.708 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -78.5 -15.7 58.31 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 118.923 0.783 . . . . 0.0 111.597 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 p -53.56 -60.69 2.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.036 0.935 . . . . 0.0 109.477 164.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -58.46 -29.15 65.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.854 1.662 . . . . 0.0 112.454 -165.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.12 -38.15 73.04 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.728 1.211 . . . . 0.0 111.394 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.424 ' C ' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.2 -55.59 32.96 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.164 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -63.02 -35.98 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.565 1.146 . . . . 0.0 110.635 -175.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.7 m95 -63.8 -38.4 90.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.686 -1.149 . . . . 0.0 112.018 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -68.62 -45.54 71.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.737 1.608 . . . . 0.0 109.868 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.6 -45.97 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 O-C-N 121.489 -0.757 . . . . 0.0 110.581 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.5 tpp -61.85 -37.05 83.04 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.868 -0.52 . . . . 0.0 109.946 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -64.92 -41.86 95.19 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.074 0.852 . . . . 0.0 111.511 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.96 -41.48 98.04 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.549 1.14 . . . . 0.0 110.186 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.7 t -73.5 -16.87 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.685 1.194 . . . . 0.0 111.174 176.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -58.15 -26.31 62.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.68 1.582 . . . . 0.0 115.22 -157.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -58.9 -22.71 60.01 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.608 1.095 . . . . 0.0 112.122 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -95.16 -2.14 50.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.326 1.45 . . . . 0.0 111.615 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -134.09 -16.73 2.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.361 1.065 . . . . 0.0 112.567 -161.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.82 -17.43 36.07 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.447 1.099 . . . . 0.0 113.44 -178.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -107.17 3.69 25.96 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.703 1.601 . . . . 0.0 111.684 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.54 18.75 2.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.43 1.492 . . . . 0.0 112.14 -175.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.3 p -92.07 73.26 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.856 1.312 . . . . 0.0 107.694 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -152.96 31.78 0.49 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.004 -172.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.72 -179.22 37.16 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.061 1.315 . . . . 0.0 110.467 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -71.83 170.32 19.06 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.521 2.814 . . . . 0.0 112.001 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 49.1 mt -135.45 155.53 50.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.501 1.52 . . . . 0.0 107.731 171.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -150.62 147.22 27.14 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.441 1.497 . . . . 0.0 107.201 -162.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 8.4 mm -131.81 141.27 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -136.73 88.89 2.4 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.706 1.602 . . . . 0.0 106.798 167.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.21 154.41 8.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 166.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.66 152.3 33.78 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 152.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.0 143.36 33.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 109.617 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.527 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -129.51 -175.83 3.71 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 127.947 2.499 . . . . 0.0 107.898 -171.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.0 -38.25 82.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -164.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.47 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.8 mmtm -142.3 28.15 1.69 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.557 1.143 . . . . 0.0 111.746 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.13 -172.61 41.04 Favored Glycine 0 CA--C 1.517 0.165 0 O-C-N 121.14 -0.975 . . . . 0.0 110.876 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.58 139.77 44.12 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 124.392 1.077 . . . . 0.0 109.447 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.527 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 18.9 mt-10 -90.79 145.74 24.54 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 161.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.0 mt -134.97 122.59 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 106.789 -1.559 . . . . 0.0 106.789 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -93.99 146.57 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 169.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.7 118.24 11.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 -171.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -124.55 173.87 8.19 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.81 0.732 . . . . 0.0 111.44 -159.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.5 mttt . . . . . 0 C--N 1.342 0.257 0 C-N-CA 125.179 1.392 . . . . 0.0 109.972 165.398 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.551 0.204 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -135.62 130.88 35.07 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 125.418 1.487 . . . . 0.0 106.998 -170.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.8 mm -122.39 152.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.51 1.524 . . . . 0.0 108.646 -173.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -143.92 149.29 36.63 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.21 1.404 . . . . 0.0 110.617 169.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -112.5 102.4 10.51 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.7 mm -70.98 -55.3 14.53 Favored 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.2 p30 -163.03 -170.39 2.31 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.99 1.716 . . . . 0.0 107.863 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.19 -20.05 63.77 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.729 -1.232 . . . . 0.0 112.509 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -108.25 -30.4 8.38 Favored 'General case' 0 CA--C 1.522 -0.103 0 O-C-N 121.136 -0.977 . . . . 0.0 111.606 -163.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.6 m -123.1 138.72 54.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.788 1.235 . . . . 0.0 108.755 -178.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -125.92 157.25 35.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 162.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -135.38 167.45 21.02 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 166.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.544 ' CE1' HG21 ' A' ' 44' ' ' VAL . 55.2 p90 -152.68 167.95 27.27 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -130.31 137.07 49.76 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 tpt -132.88 106.76 7.9 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -168.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -68.4 156.29 38.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 175.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.46 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.6 m-85 -55.66 -37.02 67.73 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.487 -0.758 . . . . 0.0 111.425 173.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.05 -32.33 83.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.371 -0.683 . . . . 0.0 112.723 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -40.17 85.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.173 1.486 . . . . 0.0 110.05 177.261 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 31.6 mt -67.0 -49.28 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.827 1.251 . . . . 0.0 109.116 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -59.63 -38.18 80.65 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 126.042 1.737 . . . . 0.0 111.293 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.76 -40.2 91.82 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.034 0.921 . . . . 0.0 110.521 -175.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -70.57 -7.95 47.85 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.282 -1.326 . . . . 0.0 111.611 173.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.42 10.31 84.72 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.926 1.25 . . . . 0.0 113.234 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -84.04 -178.5 6.99 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 168.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.47 151.14 45.96 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.024 -1.047 . . . . 0.0 108.562 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -62.95 -31.22 72.27 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -166.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.54 -42.37 13.58 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -60.53 -34.82 74.67 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 123.729 0.812 . . . . 0.0 112.175 -172.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.4 mm -41.75 -57.26 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.418 1.087 . . . . 0.0 109.137 167.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.411 ' CZ2' HG21 ' A' ' 64' ' ' VAL . 63.0 m95 -73.17 -38.68 66.1 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.821 0.449 . . . . 0.0 111.664 -173.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -89.34 4.14 49.88 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -169.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -130.74 84.31 2.18 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -51.6 -41.87 61.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.394 -0.816 . . . . 0.0 112.687 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -28.48 66.71 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.49 -0.756 . . . . 0.0 111.712 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -81.61 -18.45 44.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.417 -0.802 . . . . 0.0 111.299 175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.33 -46.69 85.47 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 163.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.537 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 8.6 tt0 -53.89 -32.91 54.96 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.213 1.005 . . . . 0.0 113.415 -171.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.427 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 1.0 OUTLIER -67.25 -32.71 73.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.422 1.489 . . . . 0.0 111.028 -176.326 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -47.34 85.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 1.4 m-30 -68.97 -43.31 75.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.295 1.038 . . . . 0.0 109.521 -173.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -54.91 -39.47 68.83 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.471 -0.776 . . . . 0.0 111.533 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.8 -39.2 90.7 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.557 1.071 . . . . 0.0 111.333 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.544 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.5 m -78.39 -39.19 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.002 -1.061 . . . . 0.0 112.02 -174.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.5 mmm -55.32 -48.11 74.63 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.3 -38.23 79.72 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.39 -16.57 9.48 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.439 1.495 . . . . 0.0 112.733 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 m -135.87 12.01 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 125.386 1.474 . . . . 0.0 111.117 -173.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -21.45 62.59 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -160.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -58.71 -28.34 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.996 0.918 . . . . 0.0 111.254 174.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -90.63 3.15 54.94 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.363 1.465 . . . . 0.0 111.327 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -134.31 -24.81 1.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 O-C-N 121.237 -0.914 . . . . 0.0 112.822 -161.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -57.28 -22.93 45.02 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.106 0.963 . . . . 0.0 113.134 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -95.53 4.52 53.11 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.115 1.366 . . . . 0.0 112.359 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.25 -24.46 2.07 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.444 1.098 . . . . 0.0 113.153 -175.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -73.43 1.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 120.142 1.337 . . . . 0.0 113.336 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -56.7 -18.53 12.69 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.123 1.369 . . . . 0.0 113.366 156.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.57 -173.44 23.04 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.433 1.492 . . . . 0.0 111.911 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.46 171.69 12.57 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.421 2.747 . . . . 0.0 111.832 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.434 HD13 ' H ' ' A' ' 61' ' ' TRP . 0.1 OUTLIER -137.98 152.1 48.58 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.346 1.459 . . . . 0.0 107.442 175.729 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.434 ' H ' HD13 ' A' ' 60' ' ' LEU . 95.3 m95 -147.85 145.04 28.55 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 125.598 1.559 . . . . 0.0 107.615 -164.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -133.79 141.28 44.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -138.24 159.39 42.17 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.77 2.028 . . . . 0.0 107.27 167.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.411 HG21 ' CZ2' ' A' ' 31' ' ' TRP . 7.1 p -146.87 162.53 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 120.553 -1.342 . . . . 0.0 110.968 -170.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.36 149.01 52.44 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 126.862 2.065 . . . . 0.0 106.041 160.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.07 129.59 55.47 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 167.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.421 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 5.0 mp -118.9 -175.3 2.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 108.319 -170.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.28 -35.52 80.61 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -166.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.5 mmtm -141.42 23.93 2.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.346 1.059 . . . . 0.0 112.124 -178.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.05 -171.4 40.58 Favored Glycine 0 N--CA 1.454 -0.138 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mp -136.77 143.08 43.04 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.432 1.093 . . . . 0.0 108.341 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.421 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.5 mt-10 -90.25 141.46 28.69 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 161.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.405 HD12 ' C ' ' A' ' 72' ' ' GLU . 0.7 OUTLIER -127.98 132.36 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 175.197 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -112.5 139.05 39.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 104.406 -2.442 . . . . 0.0 104.406 177.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.26 142.22 41.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 119.302 0.955 . . . . 0.0 109.935 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -136.86 170.86 15.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.411 0.684 . . . . 0.0 110.193 -159.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 124.862 1.265 . . . . 0.0 108.9 169.331 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.498 1.963 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -130.2 127.06 38.9 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -170.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 mm -121.55 150.43 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.876 1.27 . . . . 0.0 108.861 -170.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -146.45 150.4 35.55 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.047 1.339 . . . . 0.0 109.923 172.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.17 99.83 6.27 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -179.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -71.1 -56.09 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -168.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.0 p30 -156.27 -168.09 2.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.476 1.51 . . . . 0.0 108.376 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.4 -17.1 58.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -117.3 -53.65 2.43 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.166 -0.959 . . . . 0.0 109.671 -167.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 44.9 m -86.55 138.06 32.02 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.81 0.844 . . . . 0.0 109.48 177.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.5 m -131.65 158.98 43.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 165.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -144.32 170.38 16.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.933 -1.105 . . . . 0.0 109.975 170.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.434 ' CE1' HG21 ' A' ' 44' ' ' VAL . 53.7 p90 -151.93 167.76 27.33 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.238 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -128.92 141.08 51.39 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 173.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.4 ttt -140.8 105.67 4.95 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -167.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.1 m -65.79 149.86 49.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.427 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.2 m-85 -55.88 -32.89 64.1 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.5 -7.58 81.98 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 118.572 -1.126 . . . . 0.0 113.362 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -66.87 -49.04 66.92 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.26 2.03 . . . . 0.0 107.958 164.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.36 -46.43 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.197 1.399 . . . . 0.0 108.855 177.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.71 -36.29 80.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.328 0.251 . . . . 0.0 111.397 -176.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.39 -40.69 85.69 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.493 0.717 . . . . 0.0 111.027 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.7 mtp85 -64.07 -14.97 58.4 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.988 -1.005 . . . . 0.0 111.703 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.05 7.19 80.94 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.33 -0.705 . . . . 0.0 113.18 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -80.45 -174.88 4.87 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 166.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -138.79 148.4 43.77 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -59.08 -30.68 68.25 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.595 0.634 . . . . 0.0 112.469 -174.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -82.69 -48.78 10.5 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.33 -36.61 66.44 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.989 0.916 . . . . 0.0 112.919 -171.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -44.29 -54.76 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 124.391 1.076 . . . . 0.0 109.354 170.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -76.95 -11.96 59.88 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -121.76 7.24 9.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.695 0.798 . . . . 0.0 112.84 -167.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -136.66 87.04 2.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.473 -2.047 . . . . 0.0 105.473 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -51.12 -38.14 50.13 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -164.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.28 -32.13 58.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.614 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -79.53 -18.1 52.6 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.286 176.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -48.99 75.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 166.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -53.27 -34.74 58.49 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.292 1.437 . . . . 0.0 112.696 -169.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.424 ' H ' ' HG2' ' A' ' 39' ' ' GLU . 2.1 mm-40 -59.26 -32.98 70.5 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.377 1.471 . . . . 0.0 111.315 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.409 HD21 ' CE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -58.2 -57.84 11.09 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.418 1.087 . . . . 0.0 108.328 173.174 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HA ' HG22 ' A' ' 44' ' ' VAL . 75.9 m-85 -63.98 -36.73 84.94 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.848 1.259 . . . . 0.0 110.918 -172.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -56.11 -44.23 78.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.778 172.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.23 -41.54 76.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.498 1.045 . . . . 0.0 111.279 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.434 HG21 ' CE1' ' A' ' 13' ' ' PHE . 17.6 m -70.96 -43.21 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 121.217 -0.927 . . . . 0.0 111.389 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 50.5 tpp -56.8 -43.28 80.78 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 123.621 0.768 . . . . 0.0 109.056 172.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.55 -40.26 94.05 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.457 -0.777 . . . . 0.0 111.925 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.72 -9.45 9.25 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.604 1.561 . . . . 0.0 112.896 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.451 HG23 ' HG3' ' A' ' 52' ' ' GLU . 22.6 m -128.92 6.21 2.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 C-N-CA 124.614 1.166 . . . . 0.0 111.431 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -26.31 64.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -164.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -60.23 -22.79 63.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.986 0.914 . . . . 0.0 112.209 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -103.94 -3.23 25.0 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.167 1.387 . . . . 0.0 111.372 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.451 ' HG3' HG23 ' A' ' 48' ' ' VAL . 77.6 mm-40 -121.61 -14.8 8.11 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.222 1.009 . . . . 0.0 112.097 -169.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.64 -25.59 53.83 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.126 0.876 . . . . 0.0 112.746 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -76.24 -21.45 56.35 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.764 0.826 . . . . 0.0 112.351 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -127.21 -2.35 6.35 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 124.731 1.212 . . . . 0.0 113.646 -162.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.7 p -77.48 64.6 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 123.24 1.495 . . . . 0.0 110.329 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -159.97 35.92 0.18 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.302 1.441 . . . . 0.0 108.877 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.1 -175.93 33.64 Favored Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.819 1.676 . . . . 0.0 110.377 -173.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.28 172.22 11.5 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.53 2.82 . . . . 0.0 111.442 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.4 tp -137.79 150.62 47.36 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 173.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -143.02 147.03 34.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.075 1.35 . . . . 0.0 107.538 -170.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.9 mm -132.18 144.85 35.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -136.22 154.51 50.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.071 1.748 . . . . 0.0 106.612 162.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -140.03 160.38 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 O-C-N 121.014 -1.053 . . . . 0.0 109.801 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.76 147.25 52.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.862 2.065 . . . . 0.0 105.519 162.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.53 128.47 55.21 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 167.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.429 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -117.76 -172.82 2.31 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.616 2.366 . . . . 0.0 108.021 -169.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.92 -38.58 88.96 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.323 -0.861 . . . . 0.0 113.303 -166.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.4 mmtm -141.34 25.4 2.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.653 1.181 . . . . 0.0 112.298 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.54 -169.44 37.93 Favored Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mp -135.78 144.2 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.457 1.103 . . . . 0.0 108.437 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.429 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 26.1 mt-10 -92.61 140.6 29.38 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 160.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.403 HD12 ' C ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -128.47 127.9 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 104.443 -2.428 . . . . 0.0 104.443 175.938 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -108.89 143.66 18.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 104.776 -2.305 . . . . 0.0 104.776 176.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 131.7 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 -172.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -135.31 167.96 20.07 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.619 0.645 . . . . 0.0 110.206 -167.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? . . . . . 0 N--CA 1.468 0.447 0 C-N-CA 126.492 1.917 . . . . 0.0 107.726 175.54 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 111.412 0.153 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.28 130.49 44.6 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 125.33 1.452 . . . . 0.0 107.154 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 mm -123.63 151.22 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 120.175 1.352 . . . . 0.0 108.889 -170.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -143.37 151.2 40.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.703 1.601 . . . . 0.0 109.484 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.12 93.5 3.83 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm -66.2 -54.46 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -170.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -155.72 -160.81 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.538 1.535 . . . . 0.0 108.706 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -72.13 -10.96 60.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -175.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -130.74 -40.81 1.2 Allowed 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.273 -0.892 . . . . 0.0 111.686 -166.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.7 m -91.65 132.51 36.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.5 m -135.99 155.94 36.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 164.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.2 pttt -140.4 168.78 18.99 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.29 -0.882 . . . . 0.0 109.82 176.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -149.56 164.67 34.45 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 175.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -125.69 141.21 52.13 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 173.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.7 ttt -139.65 104.95 5.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -167.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -67.04 148.96 51.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-85 -51.83 -42.12 62.31 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.51 -11.88 80.21 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.412 -1.216 . . . . 0.0 113.842 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.9 -41.33 95.69 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.905 1.852 . . . . 0.0 109.214 166.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.3 mt -71.65 -40.98 71.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.179 1.391 . . . . 0.0 108.177 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.52 -35.67 80.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.156 0.435 . . . . 0.0 111.655 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -65.08 -40.46 94.65 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.91 0.862 . . . . 0.0 111.188 -175.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 56.8 mtt-85 -67.02 -15.18 63.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.847 1.259 . . . . 0.0 110.783 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.09 11.18 82.82 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.893 1.235 . . . . 0.0 113.055 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -83.7 -175.31 5.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 170.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -139.04 153.96 48.16 Favored 'General case' 0 CA--C 1.519 -0.231 0 O-C-N 121.247 -0.908 . . . . 0.0 108.566 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.9 ptt-85 -60.74 -29.29 69.3 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.755 1.222 . . . . 0.0 113.611 -172.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -90.6 -42.85 10.55 Favored 'General case' 0 C--O 1.226 -0.17 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -59.04 -34.41 71.89 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.193 0.997 . . . . 0.0 112.776 -174.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -42.25 -58.29 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.532 1.133 . . . . 0.0 109.364 167.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -73.04 -33.3 65.63 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.456 0.702 . . . . 0.0 112.235 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -96.2 4.84 52.13 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -168.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -128.38 88.51 2.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -50.06 -42.9 50.77 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -167.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -30.35 64.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.554 -0.716 . . . . 0.0 111.121 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -79.95 -17.55 52.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.214 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -48.8 76.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 167.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.55 -34.95 62.69 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.216 1.406 . . . . 0.0 112.408 -169.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.06 -34.73 68.55 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.897 1.279 . . . . 0.0 111.525 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -54.71 43.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.492 1.117 . . . . 0.0 108.245 175.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -66.28 -37.7 86.08 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.482 1.113 . . . . 0.0 110.665 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -57.75 -36.75 72.53 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 117.913 -1.041 . . . . 0.0 112.098 172.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -68.56 -42.92 77.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.524 1.511 . . . . 0.0 110.629 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 m -73.01 -41.31 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 121.167 -0.958 . . . . 0.0 111.075 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.2 mmt -59.2 -41.86 89.52 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.38 0.672 . . . . 0.0 110.38 170.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.89 -42.95 98.99 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.576 0.625 . . . . 0.0 111.229 176.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -8.3 15.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.554 1.541 . . . . 0.0 112.031 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.53 -3.82 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.441 1.896 . . . . 0.0 109.566 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -56.71 -28.29 60.69 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -163.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.15 -15.09 59.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.474 1.034 . . . . 0.0 113.047 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -118.68 -31.45 4.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.592 1.157 . . . . 0.0 111.162 169.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.44 -26.65 61.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.078 -1.014 . . . . 0.0 111.316 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.87 -15.56 8.94 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.817 1.19 . . . . 0.0 113.703 175.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -122.59 13.91 10.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.542 1.137 . . . . 0.0 111.721 174.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.34 -1.7 8.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.79 1.236 . . . . 0.0 112.385 171.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.0 p -75.97 68.22 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 124.848 1.259 . . . . 0.0 110.091 167.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -152.96 27.63 0.53 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.162 0.985 . . . . 0.0 110.554 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.73 178.73 46.41 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.975 1.274 . . . . 0.0 110.579 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.45 174.15 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 124.113 3.209 . . . . 0.0 111.818 -178.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -128.37 152.58 48.01 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.873 1.269 . . . . 0.0 107.776 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -140.17 151.22 45.07 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.304 1.842 . . . . 0.0 106.939 -172.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -134.27 144.12 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.949 0.795 . . . . 0.0 109.046 -172.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -137.49 155.6 49.1 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.609 1.963 . . . . 0.0 107.066 164.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.9 p -147.92 156.48 9.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 120.435 -1.415 . . . . 0.0 110.036 -172.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.03 145.77 51.65 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 164.049 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.49 132.43 51.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.15 -177.56 3.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.931 2.493 . . . . 0.0 107.97 -170.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.87 -36.52 79.42 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -164.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 45.8 mmtm -141.63 27.79 1.84 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.405 1.082 . . . . 0.0 112.01 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.66 -171.99 40.08 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -174.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.86 144.51 41.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.897 1.279 . . . . 0.0 108.384 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -94.52 137.35 33.75 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 161.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -126.52 125.43 67.24 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 N-CA-C 104.993 -2.225 . . . . 0.0 104.993 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.5 142.71 18.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.47 147.13 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 118.475 0.579 . . . . 0.0 109.761 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.26 170.19 16.46 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.173 0.989 . . . . 0.0 110.01 -164.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 mttt . . . . . 0 C--N 1.344 0.329 0 C-N-CA 124.099 0.96 . . . . 0.0 111.225 171.227 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -124.55 75.71 1.43 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -155.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 mm -65.92 153.04 8.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 125.053 1.341 . . . . 0.0 110.106 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -141.11 151.41 43.92 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.02 1.728 . . . . 0.0 110.118 170.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -114.69 89.85 3.2 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.067 1.747 . . . . 0.0 106.502 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -59.49 -53.28 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 34.6 p-10 -154.13 -166.16 2.29 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.778 2.031 . . . . 0.0 106.413 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.33 0.34 25.88 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 120.937 -1.102 . . . . 0.0 113.337 -174.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -126.59 -53.82 1.45 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 124.337 1.055 . . . . 0.0 110.051 -169.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.1 m -80.48 135.88 36.21 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 169.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.3 m -128.9 156.75 41.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 163.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.5 pttt -136.13 170.98 15.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 168.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.32 150.95 32.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -101.29 145.81 28.37 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 164.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.2 ttt -141.29 105.45 4.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 124.488 1.115 . . . . 0.0 108.195 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -66.4 150.72 48.48 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.479 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.9 m-85 -53.01 -42.63 65.81 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.11 -9.39 84.0 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 119.804 -1.189 . . . . 0.0 113.488 -175.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -66.46 -45.14 80.73 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.796 1.798 . . . . 0.0 108.854 165.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 23.0 mt -65.34 -42.15 93.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 C-N-CA 124.959 1.304 . . . . 0.0 107.706 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -62.73 -38.84 92.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.412 0.551 . . . . 0.0 111.627 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.37 -42.56 83.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.376 0.67 . . . . 0.0 110.574 -177.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.4 mtt85 -67.09 -7.96 26.99 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.14 0.976 . . . . 0.0 112.019 170.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.66 8.37 86.12 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.075 0.845 . . . . 0.0 113.058 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -85.7 -171.11 3.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 168.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -143.2 153.96 43.37 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -62.29 -33.34 74.45 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -167.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.13 -43.27 13.19 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.069 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -57.46 -35.26 69.92 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.088 0.955 . . . . 0.0 112.749 -172.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -42.61 -56.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.33 1.052 . . . . 0.0 109.475 168.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -77.04 -14.87 59.77 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.274 1.03 . . . . 0.0 113.681 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -118.66 7.09 11.63 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.874 0.87 . . . . 0.0 112.429 -167.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -130.09 86.65 2.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -50.23 -40.07 46.41 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -165.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -30.73 59.92 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.719 -0.613 . . . . 0.0 111.324 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -79.78 -16.73 54.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.296 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.94 -48.19 79.99 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 168.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -54.8 -33.73 61.85 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.212 1.405 . . . . 0.0 112.457 -170.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.36 -35.34 71.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.679 1.192 . . . . 0.0 111.277 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -55.84 29.19 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.031 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.406 ' HA ' HG22 ' A' ' 44' ' ' VAL . 67.6 m-85 -63.9 -36.48 84.08 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.468 1.107 . . . . 0.0 110.518 -175.137 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 72.1 m95 -61.21 -40.02 92.41 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.272 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -69.37 -38.13 77.91 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.666 1.575 . . . . 0.0 111.099 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' A' ' 41' ' ' PHE . 18.6 m -74.15 -40.54 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 121.03 -1.044 . . . . 0.0 111.737 178.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.1 tpp -60.79 -39.51 89.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.02 172.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.63 -38.93 75.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.698 1.135 . . . . 0.0 111.638 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.3 -8.07 5.29 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.421 1.488 . . . . 0.0 113.478 174.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.0 t -129.58 -10.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 125.596 1.558 . . . . 0.0 110.879 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.98 -29.83 68.71 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -158.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.92 -16.72 45.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.766 0.712 . . . . 0.0 112.571 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -113.43 8.48 17.89 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.188 1.795 . . . . 0.0 110.893 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -131.4 -17.14 2.99 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 125.138 1.375 . . . . 0.0 111.896 -173.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.68 -16.87 18.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -108.73 5.93 25.2 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.953 1.701 . . . . 0.0 112.006 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.54 -3.89 2.96 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.515 1.526 . . . . 0.0 112.776 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.73 67.24 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 123.156 1.455 . . . . 0.0 110.125 169.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -161.33 39.09 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.612 1.565 . . . . 0.0 108.141 -171.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.68 -174.63 27.63 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 125.727 1.632 . . . . 0.0 110.245 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.27 174.34 9.23 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.7 2.933 . . . . 0.0 111.509 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.4 tp -145.66 147.76 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.868 1.267 . . . . 0.0 108.064 173.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -144.13 147.15 33.33 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.022 1.329 . . . . 0.0 107.807 -175.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.471 HG23 HG12 ' A' ' 75' ' ' VAL . 3.7 mm -139.56 140.86 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -173.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -144.26 169.52 17.73 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.621 1.168 . . . . 0.0 109.583 161.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.2 p -146.65 162.45 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.173 -0.955 . . . . 0.0 109.955 -169.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -133.86 148.07 51.24 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 126.685 1.994 . . . . 0.0 105.631 161.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.38 129.2 55.54 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 166.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -119.47 -177.55 3.4 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.557 2.343 . . . . 0.0 108.1 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.66 -35.95 79.43 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -165.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.479 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.2 mmtm -140.96 26.3 2.06 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.478 1.111 . . . . 0.0 112.073 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.26 -171.42 39.25 Favored Glycine 0 C--O 1.228 -0.22 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 -174.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -137.59 144.96 42.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 125.186 1.394 . . . . 0.0 108.111 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -96.43 140.39 31.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 161.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -126.76 128.08 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.57 134.45 60.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 104.078 -2.564 . . . . 0.0 104.078 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.471 HG12 HG23 ' A' ' 62' ' ' ILE . 3.1 m -131.68 135.04 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -127.56 159.46 34.55 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -161.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? . . . . . 0 C--O 1.235 0.329 0 C-N-CA 125.025 1.33 . . . . 0.0 108.047 172.622 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.398 0.142 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -138.12 117.52 12.85 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -162.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 mp -112.76 152.92 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 120.649 1.568 . . . . 0.0 108.223 -177.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -137.17 150.58 48.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.387 1.875 . . . . 0.0 109.239 172.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.25 106.3 15.67 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 173.209 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 38.4 mm -70.69 -54.77 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -179.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -159.11 -168.19 2.28 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.631 1.572 . . . . 0.0 108.665 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -60.29 -15.77 28.24 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.799 1.24 . . . . 0.0 113.475 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -125.57 -46.64 1.73 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.174 -0.953 . . . . 0.0 111.785 -168.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.3 m -87.45 141.5 28.58 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -128.66 157.57 41.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 164.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -133.81 166.57 22.36 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 164.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.462 ' CE1' HG21 ' A' ' 44' ' ' VAL . 46.7 p90 -151.96 170.8 18.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.332 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -132.77 136.39 46.3 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -129.76 114.36 15.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 -171.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.97 154.63 39.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.477 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.1 m-85 -55.48 -39.02 69.89 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.389 -0.819 . . . . 0.0 111.58 173.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.34 -25.7 72.52 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-O 119.119 -0.823 . . . . 0.0 113.126 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -37.23 81.69 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.402 1.601 . . . . 0.0 109.736 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 71.1 mt -73.74 -43.18 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.07 -39.95 87.82 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.809 1.244 . . . . 0.0 111.7 176.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.89 -42.36 99.75 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.698 0.799 . . . . 0.0 111.145 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.3 mtt85 -68.19 -12.17 60.5 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.37 173.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 12.57 84.05 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.799 1.19 . . . . 0.0 112.829 -177.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -82.02 -177.72 6.72 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 168.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.418 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 9.5 t70 -132.19 146.89 52.33 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 173.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -57.11 -30.37 64.32 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.366 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -82.85 -50.05 9.04 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.933 0.788 . . . . 0.0 109.169 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.1 mm-40 -55.9 -36.0 67.17 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.228 1.011 . . . . 0.0 112.671 -171.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.72 -56.55 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.587 1.155 . . . . 0.0 109.524 169.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -76.04 -13.78 60.22 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -118.38 7.75 12.02 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.585 0.754 . . . . 0.0 112.32 -167.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -137.62 88.25 2.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.04 -2.207 . . . . 0.0 105.04 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -49.85 -42.86 48.38 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -165.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 -32.25 65.59 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 121.594 -0.691 . . . . 0.0 111.016 -178.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -77.56 -18.84 56.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.072 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -55.44 24.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 165.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -52.14 -33.96 42.42 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.498 1.519 . . . . 0.0 113.171 -166.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.426 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 1.8 mm-40 -54.52 -40.59 68.75 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.47 1.108 . . . . 0.0 111.264 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.4 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -60.21 -51.29 70.22 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.173 0.989 . . . . 0.0 109.576 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -65.55 -34.61 78.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.019 0.927 . . . . 0.0 110.131 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -62.08 -36.58 82.1 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.613 -1.184 . . . . 0.0 112.446 172.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.36 -46.63 82.58 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 121.082 1.765 . . . . 0.0 110.856 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.51 -41.49 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 121.78 -0.575 . . . . 0.0 110.762 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 tpp -59.68 -41.86 91.64 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.451 0.7 . . . . 0.0 109.715 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -62.02 -42.16 98.87 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.411 -0.805 . . . . 0.0 111.37 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -64.6 -8.43 14.19 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 126.328 1.851 . . . . 0.0 112.211 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.9 m -125.92 4.08 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.761 1.224 . . . . 0.0 111.907 175.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.47 -25.48 66.06 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -163.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -61.46 -23.25 65.73 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.451 1.023 . . . . 0.0 111.78 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -90.89 -7.59 51.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.584 1.154 . . . . 0.0 111.492 177.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.57 -23.59 2.32 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -157.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.34 -27.27 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.52 1.055 . . . . 0.0 112.539 -176.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -79.45 -10.51 59.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.164 0.985 . . . . 0.0 112.376 176.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -131.97 -10.67 3.4 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.461 1.105 . . . . 0.0 113.82 -163.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.8 m -72.59 3.56 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.73 1.605 . . . . 0.0 113.714 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -58.01 -21.21 43.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.426 1.09 . . . . 0.0 113.302 156.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.76 -175.89 38.31 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.889 1.233 . . . . 0.0 112.191 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -72.53 171.24 17.53 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 112.154 -175.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 28.6 tp -142.26 152.11 42.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.506 1.522 . . . . 0.0 106.936 166.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -142.65 152.06 42.07 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.884 1.674 . . . . 0.0 107.087 -173.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mm -135.18 142.35 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -172.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -139.61 153.7 47.41 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.57 2.348 . . . . 0.0 106.36 170.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.7 p -139.81 160.95 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.048 -1.032 . . . . 0.0 109.217 -178.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -133.92 148.06 51.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 161.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.81 128.27 55.7 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.404 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -119.22 -175.06 2.85 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.482 2.313 . . . . 0.0 107.939 -169.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -62.92 -36.75 84.43 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -165.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -141.56 25.02 2.04 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.524 1.13 . . . . 0.0 112.4 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.63 -170.72 38.82 Favored Glycine 0 CA--C 1.518 0.27 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 mp -136.9 144.57 43.56 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.061 1.344 . . . . 0.0 108.368 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.404 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 32.2 mt-10 -93.04 145.87 24.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 160.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.71 129.81 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 176.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.58 137.63 49.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 104.03 -2.582 . . . . 0.0 104.03 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.82 134.78 55.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 119.249 0.931 . . . . 0.0 109.452 175.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.3 p -131.61 176.14 8.57 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.16 0.984 . . . . 0.0 110.391 -157.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 66.5 mttt . . . . . 0 N--CA 1.466 0.358 0 C-N-CA 125.645 1.578 . . . . 0.0 111.148 175.774 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -140.05 85.85 2.05 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -150.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 mm -72.35 152.11 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 124.003 0.921 . . . . 0.0 109.357 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -141.98 151.8 42.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.716 1.607 . . . . 0.0 110.178 170.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -113.73 102.43 10.24 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.7 mm -69.04 -53.69 24.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -159.73 -166.6 1.79 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.888 1.675 . . . . 0.0 108.694 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.73 -16.38 60.97 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.248 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -126.19 -26.53 3.36 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.643 1.177 . . . . 0.0 112.725 -164.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 73.4 m -115.21 134.76 54.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.553 1.141 . . . . 0.0 108.241 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.6 m -122.44 157.57 27.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 166.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -134.76 168.09 19.66 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 162.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.462 ' CE1' HG21 ' A' ' 44' ' ' VAL . 41.0 p90 -149.77 162.51 40.13 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.15 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -117.45 126.76 53.18 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 171.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.8 ttt -115.98 108.26 16.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 125.37 1.468 . . . . 0.0 108.02 -177.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.18 147.89 51.63 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.736 171.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -51.35 -39.33 56.83 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.27 -25.17 71.03 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 118.729 -1.04 . . . . 0.0 113.237 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -70.93 -38.58 72.92 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.773 1.787 . . . . 0.0 110.822 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.1 mt -64.47 -47.27 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -58.93 -43.49 91.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.349 1.459 . . . . 0.0 111.858 174.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.68 -44.98 94.86 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.928 0.891 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -68.62 -5.29 19.17 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.018 0.927 . . . . 0.0 111.733 172.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.75 12.47 84.47 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 124.502 1.049 . . . . 0.0 112.87 175.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -78.58 -175.08 4.15 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 163.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.428 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.1 t70 -133.42 144.08 49.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.6 ptt180 -55.36 -33.51 63.47 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.785 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.06 -49.43 15.35 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.778 0.717 . . . . 0.0 109.411 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.428 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.5 mm-40 -59.76 -34.92 73.61 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.973 0.909 . . . . 0.0 112.146 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -49.94 -52.0 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 123.521 0.729 . . . . 0.0 109.566 171.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -65.73 -36.97 85.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.045 0.839 . . . . 0.0 111.243 -177.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -101.29 1.65 38.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -160.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -135.65 91.46 2.71 Favored 'General case' 0 CA--C 1.524 -0.056 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -59.59 -50.78 72.54 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -160.27 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -31.52 64.72 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 174.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -80.55 -18.51 48.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.52 175.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.96 -52.16 64.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 165.367 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -52.18 -34.09 43.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.359 1.463 . . . . 0.0 113.098 -168.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -57.52 -37.47 73.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.356 1.063 . . . . 0.0 111.646 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -56.25 24.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.761 0.824 . . . . 0.0 108.92 176.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -62.14 -35.1 77.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.732 0.813 . . . . 0.0 109.888 -176.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 63.9 m95 -65.09 -34.81 79.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.787 -1.101 . . . . 0.0 112.907 171.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -35.62 71.43 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 121.099 1.772 . . . . 0.0 111.277 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.7 m -75.02 -36.8 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 121.118 -0.989 . . . . 0.0 111.779 176.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -46.0 80.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 118.986 -0.53 . . . . 0.0 110.255 165.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.67 -34.94 73.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.697 0.681 . . . . 0.0 112.316 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.47 -17.08 11.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 112.578 173.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 30.5 m -134.78 11.67 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.592 1.557 . . . . 0.0 112.46 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -26.65 39.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.526 1.131 . . . . 0.0 113.129 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.63 -22.36 66.36 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -104.6 -39.83 6.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.668 1.187 . . . . 0.0 110.165 173.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -65.71 -21.23 66.51 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.258 -0.877 . . . . 0.0 112.177 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -58.38 -19.98 40.28 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.912 1.687 . . . . 0.0 112.384 171.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -99.7 6.22 45.61 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.415 1.486 . . . . 0.0 111.291 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.82 -4.86 1.05 Allowed 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -173.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -88.12 1.05 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 121.314 1.87 . . . . 0.0 112.397 169.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -57.35 -12.75 2.69 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.217 1.007 . . . . 0.0 112.783 149.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -130.1 -178.21 15.29 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.994 1.759 . . . . 0.0 110.695 176.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.02 177.46 7.73 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.526 2.818 . . . . 0.0 113.172 -166.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.0 tp -141.42 149.63 41.29 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.417 1.487 . . . . 0.0 107.009 166.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -145.1 151.22 38.15 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.255 1.422 . . . . 0.0 107.582 -171.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.6 mm -133.26 144.07 37.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -170.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -140.58 149.94 43.01 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.827 1.651 . . . . 0.0 107.135 163.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.6 155.92 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 120.755 -1.216 . . . . 0.0 110.143 -173.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.71 150.47 36.33 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 161.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.92 148.62 26.14 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 167.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mp -128.89 -177.06 4.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.354 2.662 . . . . 0.0 108.319 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.6 -32.52 73.55 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -169.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.448 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.1 mmtm -138.33 19.39 2.76 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.324 1.049 . . . . 0.0 112.663 -176.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 177.5 -164.98 34.46 Favored Glycine 0 C--O 1.225 -0.422 0 O-C-N 121.119 -0.988 . . . . 0.0 111.144 -175.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.5 mp -131.42 145.87 52.0 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.748 1.619 . . . . 0.0 107.264 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -103.19 130.83 50.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 160.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -118.38 128.09 75.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 105.032 -2.211 . . . . 0.0 105.032 178.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -104.41 144.51 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 168.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.87 127.64 40.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -176.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -131.74 170.59 14.6 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 118.902 0.774 . . . . 0.0 111.535 -163.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.5 mttm . . . . . 0 C--O 1.233 0.222 0 C-N-CA 124.991 1.317 . . . . 0.0 109.545 163.009 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 ptm . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.61 72.84 1.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.035 1.334 . . . . 0.0 107.959 -166.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 mm -62.03 151.88 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 124.923 1.289 . . . . 0.0 109.468 175.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -147.67 127.24 13.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.855 1.262 . . . . 0.0 110.147 172.559 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -82.22 110.38 17.36 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.467 HD11 ' HG2' ' A' ' 12' ' ' LYS . 21.0 mm -74.53 -55.71 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -156.86 -165.19 1.79 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.406 1.483 . . . . 0.0 108.643 -177.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.68 -20.86 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.14 0.976 . . . . 0.0 113.474 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -124.67 -42.3 2.08 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.966 0.906 . . . . 0.0 111.613 -166.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 55.6 m -92.2 137.85 32.02 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 m -127.07 155.77 38.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 166.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.467 ' HG2' HD11 ' A' ' 6' ' ' ILE . 42.6 pttt -129.73 171.57 12.53 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 165.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -151.42 152.42 33.04 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -105.56 142.51 35.18 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 166.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.9 ttt -138.24 104.75 5.28 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 125.017 1.327 . . . . 0.0 108.063 -172.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -67.06 154.07 42.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -51.61 -33.35 32.6 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.23 -11.2 76.26 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 119.897 -1.144 . . . . 0.0 113.41 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -68.69 -40.54 80.03 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.702 1.751 . . . . 0.0 108.846 166.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.4 mt -64.12 -46.38 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.162 1.385 . . . . 0.0 108.698 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.71 -35.3 80.36 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.47 0.308 . . . . 0.0 111.346 -177.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.33 -43.38 98.95 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.362 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.1 mtt-85 -69.35 -7.08 34.15 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.355 1.062 . . . . 0.0 111.455 174.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.62 84.6 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.412 1.006 . . . . 0.0 112.731 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -83.89 -175.13 5.66 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -141.56 148.7 39.73 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -57.01 -36.64 70.66 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.142 0.883 . . . . 0.0 111.397 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -76.06 -45.06 36.1 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.05 -37.06 81.27 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.256 -0.902 . . . . 0.0 111.866 -173.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -54.71 -44.81 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 124.146 0.978 . . . . 0.0 110.126 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -69.79 -26.48 64.29 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -120.98 8.73 10.47 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -157.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -131.48 100.59 5.2 Favored 'General case' 0 N--CA 1.458 -0.057 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -58.18 -16.69 14.48 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -165.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.34 -31.09 6.69 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.53 1.532 . . . . 0.0 111.777 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -77.71 -18.0 57.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.232 0.924 . . . . 0.0 111.124 176.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.3 p -54.39 -55.18 31.24 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.932 0.893 . . . . 0.0 109.329 165.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -56.89 -31.3 64.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.376 1.87 . . . . 0.0 112.865 -169.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -58.94 -36.13 74.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.453 1.101 . . . . 0.0 111.109 -177.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -55.69 29.04 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -62.82 -36.1 82.09 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.095 0.958 . . . . 0.0 109.809 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -62.15 -38.81 90.4 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.765 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.66 -34.74 77.54 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.39 1.45 . . . . 0.0 110.698 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.8 m -77.59 -39.44 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 120.921 -1.112 . . . . 0.0 111.795 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -42.6 77.03 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.846 -0.533 . . . . 0.0 110.098 169.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.44 -40.18 85.96 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.051 0.541 . . . . 0.0 111.849 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -60.8 -11.23 7.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.903 1.281 . . . . 0.0 112.936 173.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -123.04 5.11 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.304 1.842 . . . . 0.0 109.571 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -57.14 -31.9 65.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.245 -1.534 . . . . 0.0 114.031 -166.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.15 -12.75 42.88 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -114.95 -37.28 4.2 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.765 1.626 . . . . 0.0 110.318 175.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -58.66 -29.32 66.49 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.491 -0.755 . . . . 0.0 110.948 174.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -59.18 -13.29 6.92 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.112 1.324 . . . . 0.0 113.863 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -124.86 14.85 8.6 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.665 1.186 . . . . 0.0 111.829 173.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -128.76 -4.16 5.23 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.696 1.198 . . . . 0.0 112.973 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.4 p -78.83 62.11 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 123.362 1.553 . . . . 0.0 110.858 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -159.48 32.37 0.2 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.8 1.24 . . . . 0.0 109.314 -168.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.48 -177.16 38.22 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.753 1.644 . . . . 0.0 109.795 -177.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.6 170.89 16.5 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.294 2.663 . . . . 0.0 111.377 -179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.39 148.41 46.18 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -138.24 148.52 44.83 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.6 mm -139.34 141.41 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -143.78 161.78 37.74 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.664 0.786 . . . . 0.0 109.461 156.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.4 p -152.23 157.76 4.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 O-C-N 121.203 -0.936 . . . . 0.0 109.868 -171.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -144.74 149.56 35.75 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 162.466 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.41 146.97 32.52 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 165.119 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.07 -179.18 4.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.103 2.561 . . . . 0.0 108.163 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -62.08 -31.06 71.46 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -166.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.3 mmtm -140.39 22.0 2.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.25 1.02 . . . . 0.0 112.197 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.92 -168.79 37.99 Favored Glycine 0 CA--C 1.519 0.323 0 O-C-N 121.059 -1.026 . . . . 0.0 111.275 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.0 mp -132.38 146.38 51.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 125.793 1.637 . . . . 0.0 107.703 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.81 131.29 52.47 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 160.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -116.15 135.07 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.819 -2.289 . . . . 0.0 104.819 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -111.82 141.96 25.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 165.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.92 144.06 37.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.49 161.71 34.28 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -161.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.3 mppt? . . . . . 0 CA--C 1.534 0.332 0 C-N-CA 125.973 1.709 . . . . 0.0 108.027 174.281 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -143.08 128.01 18.39 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 -150.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.47 150.49 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 120.285 1.402 . . . . 0.0 108.675 -168.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.9 151.51 42.72 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.012 1.325 . . . . 0.0 110.032 174.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.91 103.58 11.08 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.8 mm -69.72 -55.14 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -157.18 -171.41 3.61 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.038 1.735 . . . . 0.0 108.058 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.07 -13.14 14.83 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.56 1.144 . . . . 0.0 113.593 -175.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -123.04 -52.25 1.87 Allowed 'General case' 0 C--N 1.342 0.252 0 O-C-N 121.048 -1.033 . . . . 0.0 110.851 -171.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.0 m -80.93 141.36 34.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -128.81 158.77 41.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.1 pttt -134.84 164.07 28.39 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 164.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -149.85 165.47 32.44 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -124.78 136.62 54.01 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 172.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.3 ttt -133.21 116.34 16.09 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.7 m -76.61 156.57 32.62 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.452 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.4 m-85 -55.5 -43.61 75.82 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.207 -0.933 . . . . 0.0 111.908 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.38 -9.85 86.59 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-O 118.587 -1.118 . . . . 0.0 113.451 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -66.02 -36.22 82.67 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.883 1.841 . . . . 0.0 109.062 166.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.94 -41.03 31.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.151 1.38 . . . . 0.0 107.672 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.88 -37.9 83.78 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.349 0.522 . . . . 0.0 111.502 174.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.67 -42.14 91.68 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.878 0.847 . . . . 0.0 110.895 -177.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.7 mtt85 -68.47 -8.99 45.82 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.382 172.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.95 12.98 83.87 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.457 1.027 . . . . 0.0 112.866 177.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.56 -170.74 3.26 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 165.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -142.37 150.92 41.34 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 172.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -60.94 -32.4 71.92 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -169.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -84.84 -42.65 14.89 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -57.86 -36.09 71.85 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 124.092 0.957 . . . . 0.0 112.419 -173.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.2 mm -44.15 -51.55 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.703 1.201 . . . . 0.0 110.586 169.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -78.43 -14.28 59.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.75 7.82 9.96 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -166.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -125.32 99.1 5.91 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.552 1.541 . . . . 0.0 106.958 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -54.82 -20.57 8.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.732 1.613 . . . . 0.0 115.068 -169.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.87 -30.62 9.26 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.963 0.801 . . . . 0.0 112.02 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -78.49 -16.7 57.24 Favored 'General case' 0 C--N 1.338 0.079 0 CA-C-N 118.92 0.782 . . . . 0.0 111.281 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 12.9 p -54.06 -58.56 6.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 166.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.39 -31.42 63.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.438 1.895 . . . . 0.0 112.486 -166.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 2.9 mm-40 -59.89 -35.22 74.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 111.307 -176.293 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -56.86 16.28 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 122.301 1.048 . . . . 0.0 108.548 175.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.25 -37.91 89.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.451 1.1 . . . . 0.0 110.395 -174.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -58.63 -37.0 74.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.969 172.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.52 -43.44 76.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.347 1.431 . . . . 0.0 110.388 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.8 m -71.13 -40.89 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.935 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.7 mmt -58.53 -43.28 89.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 122.802 0.441 . . . . 0.0 110.647 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -60.27 -42.09 94.64 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.584 0.629 . . . . 0.0 111.256 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -64.21 -6.0 5.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.37 1.868 . . . . 0.0 112.161 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -126.77 -0.89 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.635 1.974 . . . . 0.0 109.571 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -57.31 -28.83 63.41 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -161.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.13 -22.26 60.59 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.055 0.843 . . . . 0.0 112.415 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -100.43 -0.91 37.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.065 1.346 . . . . 0.0 111.616 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.12 -20.37 3.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.276 1.03 . . . . 0.0 111.801 -163.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -59.71 -14.48 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.942 1.297 . . . . 0.0 114.316 -174.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -126.01 18.31 7.82 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.522 1.529 . . . . 0.0 110.486 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.24 27.74 1.56 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.143 1.377 . . . . 0.0 112.061 -174.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.28 48.52 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 123.098 1.428 . . . . 0.0 107.716 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -122.35 35.48 4.87 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.469 2.308 . . . . 0.0 108.053 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.77 -177.24 37.2 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 126.418 1.961 . . . . 0.0 109.441 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -69.88 170.93 15.56 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.501 2.8 . . . . 0.0 111.943 -176.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.42 152.37 48.31 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 172.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -148.62 145.04 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.367 1.467 . . . . 0.0 107.185 -163.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.7 mm -135.33 145.41 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -133.21 148.51 52.03 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 158.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.3 p -136.22 157.77 37.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 171.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.25 151.57 37.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 159.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.01 143.54 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.402 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -125.78 -171.87 2.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.215 2.606 . . . . 0.0 107.691 -173.097 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.11 -37.96 84.61 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -166.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.452 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.3 mmtm -141.78 27.45 1.83 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.363 1.065 . . . . 0.0 112.379 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.74 -169.07 38.92 Favored Glycine 0 C--O 1.23 -0.139 0 O-C-N 120.929 -1.107 . . . . 0.0 110.478 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mp -135.26 144.35 46.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.222 1.009 . . . . 0.0 109.236 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.402 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.8 mt-10 -93.2 133.93 35.9 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.53 132.1 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -112.24 143.31 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 170.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.52 136.33 52.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 118.839 0.745 . . . . 0.0 109.365 171.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -129.69 174.98 9.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.182 0.993 . . . . 0.0 110.146 -160.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 75.7 mttt . . . . . 0 N--CA 1.465 0.283 0 C-N-CA 125.239 1.416 . . . . 0.0 110.721 172.128 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptm . . . . . 0 N--CA 1.496 1.839 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -134.75 130.71 36.62 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.0 mm -122.31 152.24 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 125.057 1.343 . . . . 0.0 108.907 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.01 152.18 46.05 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.12 1.368 . . . . 0.0 110.121 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -119.59 92.61 3.83 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.038 1.735 . . . . 0.0 106.461 177.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.9 -53.51 40.8 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -157.28 -162.98 1.29 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.006 1.722 . . . . 0.0 108.24 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -67.48 -17.12 64.57 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -123.81 -50.26 1.84 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.411 -0.805 . . . . 0.0 110.852 -164.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 27.8 m -81.42 133.07 35.36 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 170.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -128.94 159.9 40.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 163.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.4 pttt -139.13 167.14 22.73 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 164.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 44' ' ' VAL . 53.8 p90 -148.95 166.69 27.86 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -125.38 133.99 52.33 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 106.128 -1.805 . . . . 0.0 106.128 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.4 tpt -129.42 107.23 9.34 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -169.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.67 154.62 41.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.9 m-85 -53.52 -37.91 63.26 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.707 -0.621 . . . . 0.0 111.893 175.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.54 -26.08 74.85 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.304 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.81 -30.66 69.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.692 1.746 . . . . 0.0 110.316 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.97 -44.62 28.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -58.9 -39.82 82.62 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 124.835 1.254 . . . . 0.0 111.631 175.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.98 -44.16 97.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.96 0.886 . . . . 0.0 111.257 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 79.3 mtt85 -72.09 -5.6 36.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.677 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 11.64 85.02 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.719 1.152 . . . . 0.0 112.903 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -85.05 -175.09 5.61 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 168.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -135.33 146.54 48.54 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 173.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -52.86 -35.28 57.4 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.991 0.814 . . . . 0.0 111.119 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -80.39 -45.11 18.25 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.537 1.135 . . . . 0.0 108.967 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -61.18 -36.09 78.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.213 1.005 . . . . 0.0 112.319 -176.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.88 -49.87 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -84.21 -26.4 28.76 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -97.39 -17.08 19.92 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.937 0.495 . . . . 0.0 111.316 -167.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.8 -171.48 3.54 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 158.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -135.98 -48.01 0.67 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.186 -0.946 . . . . 0.0 111.136 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -34.64 76.54 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.369 0.668 . . . . 0.0 110.605 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -79.84 -12.54 59.75 Favored 'General case' 0 C--N 1.34 0.182 0 O-C-N 121.49 -0.756 . . . . 0.0 111.925 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.71 -41.5 75.26 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 168.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.603 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 15.7 tt0 -56.28 -30.98 63.19 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.128 1.371 . . . . 0.0 113.013 -171.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.76 -33.5 75.79 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.653 1.981 . . . . 0.0 111.033 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -44.88 92.24 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.603 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -71.12 -40.68 71.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.652 0.781 . . . . 0.0 108.958 -173.885 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -56.45 -40.44 74.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.369 171.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.05 -22.26 65.6 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.396 0.998 . . . . 0.0 113.08 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -103.99 -38.09 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 119.846 1.203 . . . . 0.0 111.853 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -43.27 64.68 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 163.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.86 -44.64 66.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 123.779 0.832 . . . . 0.0 112.441 173.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -62.62 -7.37 4.64 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 t -129.02 -2.95 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 126.059 1.744 . . . . 0.0 110.003 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -59.99 -29.88 68.75 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.515 -1.365 . . . . 0.0 114.517 -159.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.84 -11.69 40.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.413 0.685 . . . . 0.0 112.46 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -113.82 -31.73 6.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.229 1.812 . . . . 0.0 110.623 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.26 -28.27 67.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.415 1.007 . . . . 0.0 111.009 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.28 -22.31 40.7 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.139 0.881 . . . . 0.0 112.747 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -83.75 -10.65 57.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.904 0.775 . . . . 0.0 112.335 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -138.15 4.83 2.5 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.294 1.038 . . . . 0.0 113.581 -165.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.59 77.6 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-O 122.801 1.286 . . . . 0.0 109.033 174.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -147.82 22.88 1.11 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.918 1.287 . . . . 0.0 110.827 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.25 176.89 42.59 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.796 1.189 . . . . 0.0 110.435 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.74 164.69 33.12 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.798 2.999 . . . . 0.0 112.03 -174.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.1 mt -87.53 158.93 18.8 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 164.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -143.18 141.75 31.23 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.57 143.17 39.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.386 0.994 . . . . 0.0 108.727 -172.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -137.38 155.66 49.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.147 1.379 . . . . 0.0 107.718 165.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.91 160.21 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 O-C-N 120.744 -1.222 . . . . 0.0 110.178 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.05 152.15 44.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 157.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.0 143.59 30.95 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.131 0.573 . . . . 0.0 109.618 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -125.93 -175.6 3.4 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.255 2.622 . . . . 0.0 107.599 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.9 -35.54 80.38 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -164.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.6 mmtm -141.07 25.54 2.09 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 112.14 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.91 -173.45 42.49 Favored Glycine 0 C--O 1.228 -0.27 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -175.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.52 144.86 46.54 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.478 1.111 . . . . 0.0 108.82 177.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -94.54 129.49 41.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 161.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.95 127.24 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mp -95.8 147.09 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 166.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.97 139.99 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 172.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -134.94 168.47 19.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.097 0.959 . . . . 0.0 108.622 -173.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 mppt? -144.68 151.51 39.04 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.505 1.122 . . . . 0.0 109.903 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.74 -24.16 66.9 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 112.783 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -57.57 -23.68 51.98 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.773 0.829 . . . . 0.0 112.169 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.0 tp -50.26 -29.37 9.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.93 172.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.5 m -129.75 32.9 4.52 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.011 1.324 . . . . 0.0 110.492 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -60.7 -46.81 88.96 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.562 -0.711 . . . . 0.0 109.486 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -75.42 123.08 24.79 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 163.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 tp -159.68 -44.39 0.05 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.607 0.763 . . . . 0.0 110.53 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -59.86 -26.71 66.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -173.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -68.05 -23.58 64.98 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -76.67 140.49 40.93 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 119.123 0.874 . . . . 0.0 108.723 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.4 158.95 62.55 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 125.296 1.438 . . . . 0.0 108.125 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -84.51 30.63 0.51 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.296 3.331 . . . . 0.0 112.601 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.614 1.966 . . . . 0.0 108.213 -172.848 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.737 0.303 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -124.98 77.95 1.66 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -160.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 mm -68.43 150.45 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.763 1.225 . . . . 0.0 109.327 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -151.66 102.25 2.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.355 1.062 . . . . 0.0 110.226 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -72.78 118.38 15.65 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.267 -1.521 . . . . 0.0 106.907 171.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 32.9 mm -81.92 -53.54 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -163.62 -175.14 4.01 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.894 1.677 . . . . 0.0 108.873 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.08 -14.99 1.81 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.366 1.467 . . . . 0.0 114.931 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -119.19 -27.26 5.71 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.265 1.426 . . . . 0.0 112.802 -167.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -129.81 140.79 50.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.457 1.103 . . . . 0.0 109.27 -172.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.8 m -130.07 153.64 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 106.219 -1.771 . . . . 0.0 106.219 166.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -132.29 168.31 18.31 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 168.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.521 ' CE1' HG21 ' A' ' 44' ' ' VAL . 40.8 p90 -155.0 165.17 37.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -118.69 140.91 49.17 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -132.38 112.13 11.91 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.9 m -73.19 156.97 38.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.1 m-85 -52.06 -43.44 63.81 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 121.985 -0.447 . . . . 0.0 111.745 173.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -78.81 -12.07 84.57 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 119.707 -1.235 . . . . 0.0 113.817 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -34.39 75.54 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.688 1.744 . . . . 0.0 109.422 165.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.15 -42.11 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -61.33 -37.54 83.65 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.735 0.698 . . . . 0.0 111.515 175.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.47 -42.51 98.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.838 0.828 . . . . 0.0 110.898 -176.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -72.39 -4.83 32.44 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.564 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.62 11.19 85.52 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.479 1.038 . . . . 0.0 113.071 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -82.86 -173.13 4.5 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 168.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -138.53 147.05 42.67 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 174.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.6 ptt85 -56.93 -35.5 69.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.676 0.671 . . . . 0.0 111.597 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.62 -45.52 29.8 Favored 'General case' 0 C--O 1.226 -0.147 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.97 -37.02 78.39 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 121.429 -0.795 . . . . 0.0 111.838 -172.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -53.32 -47.43 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.58 0.752 . . . . 0.0 109.947 171.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 m95 -68.64 -21.71 64.45 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.266 0.939 . . . . 0.0 112.943 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -120.56 4.06 10.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -161.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -137.87 83.56 1.99 Allowed 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -47.43 -42.77 23.06 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.58 -32.09 63.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.479 -0.763 . . . . 0.0 111.288 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -77.82 -19.66 54.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.95 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -51.96 64.89 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 166.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -52.42 -34.37 48.1 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.229 1.412 . . . . 0.0 113.228 -169.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.4 -36.56 69.06 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.797 1.239 . . . . 0.0 111.646 -179.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -53.06 62.63 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.093 0.957 . . . . 0.0 109.069 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -66.36 -32.42 73.8 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.398 1.079 . . . . 0.0 110.66 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -65.26 -44.43 88.12 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.889 170.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.94 -41.56 95.41 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.079 1.309 . . . . 0.0 110.878 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.521 HG21 ' CE1' ' A' ' 13' ' ' PHE . 27.9 m -68.96 -44.01 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 O-C-N 121.251 -0.906 . . . . 0.0 112.147 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 43.9 tpp -59.35 -39.56 83.63 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.03 -38.33 88.29 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.529 -0.732 . . . . 0.0 111.894 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.16 -13.8 41.38 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.52 1.528 . . . . 0.0 113.221 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 33.6 m -123.33 -5.34 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.361 1.064 . . . . 0.0 111.939 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -18.15 12.08 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -66.1 -16.9 64.34 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 120.277 1.399 . . . . 0.0 112.437 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -113.63 -36.88 4.76 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.483 0.713 . . . . 0.0 110.87 162.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -68.1 -13.07 61.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 118.003 -0.999 . . . . 0.0 112.473 -175.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -57.13 -27.41 61.82 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.486 1.494 . . . . 0.0 112.029 168.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -79.42 -5.87 55.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.285 0.634 . . . . 0.0 111.998 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.02 36.96 1.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.641 1.176 . . . . 0.0 111.205 -166.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.8 p -117.47 66.04 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 123.628 1.68 . . . . 0.0 106.577 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -153.18 36.41 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 113.942 -1.481 . . . . 0.0 109.251 -168.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.45 -176.25 39.21 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 126.087 1.803 . . . . 0.0 109.753 -173.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.45 170.07 12.95 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.459 2.773 . . . . 0.0 110.905 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.46 HD23 ' H ' ' A' ' 61' ' ' TRP . 0.5 OUTLIER -137.36 147.57 45.61 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.331 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.46 ' H ' HD23 ' A' ' 60' ' ' LEU . 90.4 m95 -143.74 144.19 31.72 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.557 1.543 . . . . 0.0 107.281 -164.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.454 HG23 HG12 ' A' ' 75' ' ' VAL . 3.8 mm -137.19 138.1 45.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -170.041 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -136.28 147.66 47.6 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.441 1.896 . . . . 0.0 107.641 169.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.37 154.74 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 O-C-N 120.975 -1.078 . . . . 0.0 109.671 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -144.85 150.22 36.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 161.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.68 146.94 26.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 169.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.67 179.81 5.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.976 2.51 . . . . 0.0 108.315 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -58.39 -36.48 73.62 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -168.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.506 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 34.0 mmtp -139.16 27.14 2.37 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.119 0.967 . . . . 0.0 112.329 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.08 -168.32 37.38 Favored Glycine 0 CA--C 1.521 0.409 0 O-C-N 121.005 -1.059 . . . . 0.0 111.692 -174.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -133.0 145.19 50.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.112 1.765 . . . . 0.0 107.516 176.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -103.09 136.52 42.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 159.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.443 HD13 ' CE2' ' A' ' 13' ' ' PHE . 1.0 OUTLIER -123.58 131.38 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 178.767 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -111.84 136.51 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 168.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.454 HG12 HG23 ' A' ' 62' ' ' ILE . 4.2 m -131.08 141.94 44.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 119.569 1.077 . . . . 0.0 108.696 172.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.2 p -134.38 162.91 30.89 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -161.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 162.67 36.03 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.28 1.832 . . . . 0.0 107.492 174.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.98 146.67 46.13 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -70.73 170.16 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.126 0.57 . . . . 0.0 109.967 171.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 56.3 tp -136.71 152.88 50.87 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 171.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 p -61.97 -10.56 10.02 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -169.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -53.92 -47.51 71.13 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.265 0.939 . . . . 0.0 109.29 165.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -82.74 45.45 0.99 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.189 1.795 . . . . 0.0 110.335 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.7 tt -148.64 -55.19 0.2 Allowed 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 174.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -69.49 -40.06 77.25 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 122.357 0.263 . . . . 0.0 111.289 177.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -124.17 175.6 6.92 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.898 2.079 . . . . 0.0 109.802 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 69.9 mt -77.83 168.79 19.37 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 156.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 158.76 74.77 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 123.906 0.882 . . . . 0.0 109.228 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.66 149.45 32.07 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.777 2.985 . . . . 0.0 113.743 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 . . . . . 0 C--O 1.253 1.261 0 CA-C-N 114.572 -1.195 . . . . 0.0 108.57 163.458 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ptm . . . . . 0 N--CA 1.495 1.805 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.81 76.93 1.24 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.155 1.382 . . . . 0.0 107.794 -161.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -66.83 153.01 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 124.523 1.129 . . . . 0.0 109.599 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -146.76 138.17 24.3 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.972 1.309 . . . . 0.0 109.413 168.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mmt85 -89.85 126.45 35.71 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.98 -1.075 . . . . 0.0 108.142 166.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.453 HD11 ' HG2' ' A' ' 12' ' ' LYS . 24.1 mm -83.01 -61.94 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 172.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -153.55 17.7 0.53 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 111.526 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 74.16 -34.63 0.28 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 128.074 2.549 . . . . 0.0 113.603 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -68.56 -38.48 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.428 1.013 . . . . 0.0 108.859 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.1 m -110.12 140.4 44.24 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.642 1.577 . . . . 0.0 107.484 168.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 m -129.1 162.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 166.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HG2' HD11 ' A' ' 6' ' ' ILE . 49.9 pttt -135.39 172.74 12.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.763 -1.211 . . . . 0.0 109.683 165.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -144.8 160.55 41.08 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 168.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -118.27 149.5 41.02 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 162.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 4.8 ttt -144.64 103.41 3.93 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 -168.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.8 m -67.48 153.19 44.27 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.9 m-85 -53.12 -31.63 43.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.81 -25.51 73.06 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-O 119.066 -0.852 . . . . 0.0 113.663 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.86 -37.0 75.98 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.757 1.779 . . . . 0.0 109.739 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 11.3 mt -68.49 -44.71 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.405 1.482 . . . . 0.0 109.178 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -58.46 -38.92 78.55 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.587 1.155 . . . . 0.0 111.439 174.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.66 -40.7 97.86 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.518 0.675 . . . . 0.0 111.69 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtt-85 -68.51 -11.84 60.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.016 1.327 . . . . 0.0 111.27 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.51 3.19 78.36 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.61 1.576 . . . . 0.0 112.179 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.404 ' CE2' ' HG2' ' A' ' 39' ' ' GLU . 24.7 m-85 -90.19 -178.41 5.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.788 1.235 . . . . 0.0 110.081 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -137.89 153.33 49.55 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -60.65 -31.92 71.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.467 -170.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -81.79 -46.26 14.44 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -56.83 -35.73 69.16 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.0 0.92 . . . . 0.0 112.751 -171.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.1 mm -44.39 -53.49 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.604 1.162 . . . . 0.0 109.339 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 50.1 m95 -75.01 -17.07 60.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -115.33 8.95 15.53 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.328 0.651 . . . . 0.0 112.334 -165.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -142.03 92.42 2.44 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -50.86 -46.97 60.51 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.556 1.071 . . . . 0.0 112.655 -166.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.01 -21.52 65.94 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.565 -0.71 . . . . 0.0 111.515 -176.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -98.67 -5.63 31.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.062 1.345 . . . . 0.0 111.632 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.92 -49.85 14.63 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -55.78 -32.74 63.74 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.538 1.135 . . . . 0.0 112.921 -170.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.404 ' HG2' ' CE2' ' A' ' 25' ' ' PHE . 3.1 pp20? -53.15 -37.13 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.798 0.839 . . . . 0.0 111.848 174.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -59.07 6.0 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.412 ' HA ' HG22 ' A' ' 44' ' ' VAL . 76.9 m-85 -64.24 -40.02 95.16 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.073 1.349 . . . . 0.0 110.335 -173.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -61.13 -36.92 81.03 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 117.729 -1.129 . . . . 0.0 112.434 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -72.42 -37.18 68.7 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.669 1.577 . . . . 0.0 111.549 178.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 41' ' ' PHE . 17.6 m -70.47 -41.45 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 120.006 1.276 . . . . 0.0 111.152 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -42.08 87.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.934 -0.479 . . . . 0.0 110.445 170.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -58.06 -40.89 82.11 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 122.757 0.423 . . . . 0.0 111.269 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.57 -5.25 2.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.927 1.691 . . . . 0.0 112.78 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.5 t -131.94 2.76 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 126.404 1.881 . . . . 0.0 109.895 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -55.76 -37.47 68.57 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.162 -1.587 . . . . 0.0 113.985 -162.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.38 -8.76 27.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -119.06 -36.13 3.47 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.787 2.035 . . . . 0.0 109.901 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -57.17 -31.85 65.82 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.931 0.892 . . . . 0.0 110.984 170.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -57.39 -21.98 39.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.68 1.127 . . . . 0.0 112.854 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -83.97 -14.23 51.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.893 0.77 . . . . 0.0 112.381 176.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.95 -0.42 3.1 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -165.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.57 69.27 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 122.994 1.378 . . . . 0.0 110.404 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -155.73 27.73 0.38 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.062 1.345 . . . . 0.0 110.195 -173.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.44 -178.82 38.82 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.021 1.296 . . . . 0.0 110.557 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.9 169.49 18.97 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.762 2.975 . . . . 0.0 111.962 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.4 tp -129.72 148.15 51.57 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.48 1.512 . . . . 0.0 107.12 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -140.02 146.87 39.58 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -170.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -135.52 142.76 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -140.13 91.21 2.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.95 1.3 . . . . 0.0 108.196 165.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.82 154.59 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.521 0.728 . . . . 0.0 109.078 166.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.0 152.05 32.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 152.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.57 143.29 32.93 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 123.612 0.765 . . . . 0.0 109.883 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.475 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.7 mp -129.46 -176.03 3.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.968 2.507 . . . . 0.0 108.306 -172.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.04 -34.77 76.87 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -140.42 21.69 2.38 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.303 1.041 . . . . 0.0 112.355 -177.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.9 -170.15 40.48 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mp -134.74 142.62 46.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.863 1.265 . . . . 0.0 109.262 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.475 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 20.8 mt-10 -94.57 143.5 26.37 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 162.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.93 123.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.4 mp -92.42 145.64 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 104.675 -2.343 . . . . 0.0 104.675 167.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.65 131.73 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.84 159.41 39.89 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -165.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 mppt? -145.55 165.66 27.99 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 126.97 2.108 . . . . 0.0 108.39 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.25 160.66 10.13 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 164.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -59.43 146.24 40.82 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.828 0.451 . . . . 0.0 110.375 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.6 -32.82 74.63 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.027 0.531 . . . . 0.0 110.627 175.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 p -73.87 42.4 0.14 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.532 1.933 . . . . 0.0 111.782 172.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -54.89 -32.37 60.86 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.32 1.448 . . . . 0.0 110.907 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -139.69 176.18 8.95 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 155.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 57.9 tp -152.72 -42.01 0.1 Allowed 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.583 1.153 . . . . 0.0 110.085 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.86 -33.65 76.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.367 0.53 . . . . 0.0 111.482 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -95.33 36.67 1.22 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.0 0.92 . . . . 0.0 111.1 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 159.5 2.45 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 122.747 0.419 . . . . 0.0 111.584 169.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 m -139.79 160.29 61.54 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.227 1.411 . . . . 0.0 108.783 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.82 156.72 14.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.933 3.089 . . . . 0.0 113.264 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 93.4 mtt-85 . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.471 -0.776 . . . . 0.0 108.974 169.789 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.797 0.332 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -127.4 78.09 1.79 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -151.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 mp -76.8 153.71 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.494 1.118 . . . . 0.0 109.772 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -134.69 156.14 49.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.312 2.245 . . . . 0.0 108.154 170.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -124.29 89.34 3.06 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 176.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.0 -52.83 56.55 Favored 'Isoleucine or valine' 0 C--N 1.345 0.399 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -157.14 -164.1 1.53 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.189 1.796 . . . . 0.0 107.206 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -72.49 -9.93 59.17 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -176.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -126.6 -40.63 1.91 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.042 -1.036 . . . . 0.0 112.184 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.8 m -92.86 134.53 34.99 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 165.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 m -128.88 156.55 41.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 165.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -142.13 169.66 17.18 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 121.018 -1.052 . . . . 0.0 108.558 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.559 ' CD1' HG21 ' A' ' 44' ' ' VAL . 38.1 p90 -153.52 163.62 39.65 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 172.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -115.31 143.12 45.74 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -136.85 108.24 6.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.81 1.244 . . . . 0.0 107.872 -175.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -68.1 153.94 42.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-30 -52.2 -38.7 58.66 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 122.851 0.461 . . . . 0.0 112.121 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.79 -25.52 70.58 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 119.24 -0.755 . . . . 0.0 113.385 -177.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -69.31 -38.71 78.38 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.995 1.397 . . . . 0.0 109.979 175.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.54 -43.56 71.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 125.452 1.501 . . . . 0.0 108.345 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.92 -40.84 85.75 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.03 1.332 . . . . 0.0 111.581 175.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -62.85 -42.06 99.6 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.566 0.698 . . . . 0.0 111.237 -177.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -68.46 -13.19 62.14 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.916 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.1 13.32 83.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.734 1.159 . . . . 0.0 112.953 -176.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -82.86 -173.74 4.85 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.431 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.4 t70 -141.89 147.49 37.21 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -53.72 -35.77 61.54 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.834 0.743 . . . . 0.0 111.443 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.78 -42.1 25.15 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.313 0.506 . . . . 0.0 109.863 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.431 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.92 -37.71 85.68 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.05 -1.031 . . . . 0.0 111.058 -175.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.63 -43.87 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.797 1.239 . . . . 0.0 110.254 170.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.59 -28.35 66.86 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.121 0.873 . . . . 0.0 113.057 177.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -120.92 8.79 10.51 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -155.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -132.18 98.17 4.34 Favored 'General case' 0 C--N 1.335 -0.053 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.2 ttp85 -54.27 -23.45 15.04 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.245 1.418 . . . . 0.0 114.74 -169.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 -31.16 10.69 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 118.902 0.774 . . . . 0.0 111.864 178.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -79.83 -17.47 53.2 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.068 0.849 . . . . 0.0 111.316 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 p -59.35 -53.3 59.81 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 167.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -30.94 63.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.316 1.846 . . . . 0.0 113.25 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.411 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.6 mm-40 -58.54 -34.29 70.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.53 1.132 . . . . 0.0 111.165 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -52.71 64.54 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 122.501 1.143 . . . . 0.0 109.023 175.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -67.82 -33.3 74.52 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.806 0.843 . . . . 0.0 109.851 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -63.23 -29.9 71.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.578 172.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -76.52 -45.11 32.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.289 1.404 . . . . 0.0 108.843 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.559 HG21 ' CD1' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -61.94 -49.33 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.631 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 36.8 tpp -63.81 -34.8 78.72 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.54 -177.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.04 -41.03 82.4 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 119.061 0.846 . . . . 0.0 111.212 174.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -35.78 78.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.768 0.427 . . . . 0.0 111.178 175.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.99 -13.06 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.088 178.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 52' ' ' GLU . 3.4 t-80 -60.01 -30.41 69.13 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -152.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -62.25 -21.09 64.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.12 0.873 . . . . 0.0 112.268 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -96.46 -1.66 46.94 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.629 1.572 . . . . 0.0 110.924 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 49' ' ' HIS . 46.1 mm-40 -135.61 -15.74 1.83 Allowed 'General case' 0 C--N 1.338 0.092 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -158.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.58 -10.22 4.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.298 1.039 . . . . 0.0 113.293 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -117.46 13.76 14.49 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.88 2.072 . . . . 0.0 111.365 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.59 -22.99 1.65 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.924 1.29 . . . . 0.0 113.074 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -70.81 -4.29 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 120.638 1.563 . . . . 0.0 113.728 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -55.23 -20.62 11.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.517 1.527 . . . . 0.0 114.021 159.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -93.32 -173.39 40.24 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.637 1.113 . . . . 0.0 112.661 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -68.55 173.18 10.23 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.584 2.856 . . . . 0.0 111.08 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.1 mt -146.22 149.96 34.91 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.636 1.175 . . . . 0.0 108.431 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -147.7 148.01 30.56 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.165 1.386 . . . . 0.0 108.012 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 2.4 mm -135.51 149.4 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -138.82 143.5 38.9 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 161.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.4 p -147.76 157.06 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 O-C-N 120.405 -1.435 . . . . 0.0 109.876 -168.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -149.78 150.98 32.83 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 167.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.66 145.27 29.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 164.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -126.23 -179.8 4.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.779 2.432 . . . . 0.0 107.858 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.08 -32.26 71.91 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -166.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.505 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.0 mmtm -140.64 23.08 2.31 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.214 1.005 . . . . 0.0 112.227 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.16 -170.24 38.62 Favored Glycine 0 C--N 1.332 0.325 0 O-C-N 120.917 -1.114 . . . . 0.0 110.895 -173.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.6 mp -131.06 148.15 52.71 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.744 1.617 . . . . 0.0 107.297 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -105.38 136.12 45.5 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 158.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -127.05 120.36 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 105.007 -2.22 . . . . 0.0 105.007 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -102.61 143.65 14.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 104.634 -2.358 . . . . 0.0 104.634 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.15 141.05 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 172.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -135.92 164.2 28.51 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.361 0.664 . . . . 0.0 109.676 -165.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.29 163.05 38.22 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.655 1.582 . . . . 0.0 108.158 172.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.29 158.16 21.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -63.9 132.16 49.91 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.7 tp -64.52 -34.31 77.94 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.234 0.614 . . . . 0.0 109.956 174.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -70.76 12.94 0.22 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.577 1.951 . . . . 0.0 114.095 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.81 -29.83 42.4 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.915 0.886 . . . . 0.0 111.136 172.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -134.16 167.25 21.0 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 158.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 50.8 tp -152.63 -34.13 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.062 1.345 . . . . 0.0 110.287 -176.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.02 -41.71 92.76 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.012 0.525 . . . . 0.0 110.495 169.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -79.31 115.13 18.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 164.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 45.6 mt -67.83 160.44 28.33 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.349 1.059 . . . . 0.0 110.067 173.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.5 m -63.73 158.63 59.24 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 162.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.37 154.72 14.17 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 124.0 3.133 . . . . 0.0 113.522 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 126.398 1.879 . . . . 0.0 107.432 179.049 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptm . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -127.55 79.61 1.9 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -152.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 mm -75.06 152.07 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 124.732 1.213 . . . . 0.0 109.804 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -141.95 148.35 38.49 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.579 1.952 . . . . 0.0 108.508 167.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.37 102.53 9.01 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.2 mm -70.93 -56.03 12.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 -170.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -162.61 -171.37 2.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.792 1.637 . . . . 0.0 108.84 -177.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.28 -6.12 8.91 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -118.91 -31.06 4.88 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.937 1.295 . . . . 0.0 111.601 -169.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.0 m -129.5 140.18 51.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.465 1.106 . . . . 0.0 109.278 -170.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.69 155.53 41.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 166.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -136.85 167.79 20.8 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.425 ' CE1' HG21 ' A' ' 44' ' ' VAL . 34.1 p90 -155.49 164.13 39.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.608 0.718 . . . . 0.0 109.351 172.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -114.93 142.61 46.36 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -136.43 115.53 12.42 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -72.77 158.66 35.15 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -53.61 -42.19 67.44 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 121.784 -0.573 . . . . 0.0 111.423 171.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.84 -27.05 69.51 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.167 -0.796 . . . . 0.0 113.043 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.92 -31.48 69.28 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.446 1.623 . . . . 0.0 110.778 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.8 mt -79.0 -43.97 24.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.837 1.255 . . . . 0.0 107.796 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -58.68 -40.71 84.36 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.289 1.436 . . . . 0.0 111.861 173.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.37 -44.62 95.44 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.165 0.986 . . . . 0.0 111.47 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -69.52 -6.88 33.63 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.578 173.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 12.91 84.16 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.465 1.031 . . . . 0.0 113.07 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -82.28 -174.28 5.04 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.419 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 7.7 t70 -137.35 144.65 42.64 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -55.63 -35.49 65.97 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.249 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -76.74 -44.49 33.01 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 118.708 0.686 . . . . 0.0 109.611 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.419 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.02 -37.7 83.49 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 121.389 -0.819 . . . . 0.0 111.311 -173.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -54.2 -45.82 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.78 0.832 . . . . 0.0 109.909 171.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -68.37 -22.2 64.67 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.452 1.024 . . . . 0.0 113.14 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -121.9 3.81 9.97 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -160.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -137.75 82.22 1.91 Allowed 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -178.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -46.28 -43.36 15.65 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.191 0.996 . . . . 0.0 113.654 -166.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.23 -32.21 64.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.684 -0.635 . . . . 0.0 111.683 -177.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -77.78 -20.39 53.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.647 -0.692 . . . . 0.0 110.968 174.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -52.72 62.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 166.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -52.59 -34.1 49.25 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.681 1.592 . . . . 0.0 113.311 -168.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -55.74 -36.32 67.13 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.979 1.311 . . . . 0.0 111.51 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -57.69 11.94 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.437 1.095 . . . . 0.0 108.829 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -62.6 -35.5 79.73 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.962 1.305 . . . . 0.0 110.033 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -62.87 -39.37 94.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.114 171.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -68.35 -41.88 80.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.31 1.414 . . . . 0.0 110.232 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.425 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -68.72 -42.25 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 121.331 -0.856 . . . . 0.0 111.458 -178.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.9 mmt -54.5 -48.58 71.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.177 0.591 . . . . 0.0 109.674 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.74 -41.32 90.71 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 122.521 0.329 . . . . 0.0 111.498 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -65.53 -12.54 53.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.195 1.798 . . . . 0.0 112.488 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.64 1.16 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.266 1.026 . . . . 0.0 111.778 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.55 -20.82 65.05 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -163.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.04 -20.84 60.01 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.403 1.001 . . . . 0.0 112.13 173.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -103.72 5.96 36.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.138 1.375 . . . . 0.0 111.144 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.16 -20.95 4.74 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.806 1.243 . . . . 0.0 111.93 -173.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.51 -18.58 59.73 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.277 1.031 . . . . 0.0 113.768 -173.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -102.88 3.57 36.7 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.272 1.429 . . . . 0.0 111.761 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.71 40.91 1.3 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.123 1.769 . . . . 0.0 109.869 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.94 66.61 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -153.89 37.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 113.513 -1.676 . . . . 0.0 108.86 -168.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.9 -175.31 35.53 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 126.099 1.809 . . . . 0.0 109.906 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.44 172.27 12.63 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.5 2.8 . . . . 0.0 111.465 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 35.6 mt -135.65 154.18 51.39 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.219 1.408 . . . . 0.0 107.955 171.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.9 m95 -149.2 145.7 27.26 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 125.245 1.418 . . . . 0.0 107.519 -164.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -134.82 143.71 36.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -175.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -137.6 147.44 45.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.083 1.753 . . . . 0.0 106.67 165.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.1 p -150.39 155.66 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 120.647 -1.283 . . . . 0.0 109.719 -170.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -148.95 150.63 33.2 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 164.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.19 146.16 26.12 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 167.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.32 -177.49 4.09 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.779 2.432 . . . . 0.0 108.045 177.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.51 -33.8 73.16 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -139.6 23.6 2.48 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.464 1.106 . . . . 0.0 112.607 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -179.53 -165.26 33.34 Favored Glycine 0 CA--C 1.521 0.444 0 O-C-N 121.11 -0.994 . . . . 0.0 111.624 -173.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 mp -132.48 148.55 52.4 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.939 1.696 . . . . 0.0 108.041 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -103.33 138.62 39.84 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 156.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.414 HD13 ' CE2' ' A' ' 13' ' ' PHE . 1.1 mp -127.2 129.14 70.89 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.026 0 N-CA-C 104.92 -2.252 . . . . 0.0 104.92 -178.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -112.17 141.98 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 170.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.0 m -135.9 138.39 47.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 121.243 -0.911 . . . . 0.0 108.549 171.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -133.75 166.87 21.63 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.169 0.588 . . . . 0.0 110.726 -160.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -137.43 168.85 18.82 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.164 1.786 . . . . 0.0 110.241 167.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.47 144.05 43.56 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.172 171.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -72.89 172.42 10.91 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.104 0.962 . . . . 0.0 110.587 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 21.4 tp -133.14 37.86 3.37 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.031 1.333 . . . . 0.0 109.456 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -13.21 9.85 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.022 1.329 . . . . 0.0 114.066 -175.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -54.22 -30.73 51.04 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.001 1.273 . . . . 0.0 111.429 168.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.65 -8.11 5.99 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.094 1.358 . . . . 0.0 113.518 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.7 mt -129.74 -40.99 1.35 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.938 1.695 . . . . 0.0 110.021 -173.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.42 -31.98 71.7 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.606 0.762 . . . . 0.0 111.575 176.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -100.9 158.65 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.135 0.574 . . . . 0.0 109.523 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.91 151.4 47.19 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 172.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.2 m -140.12 159.26 64.79 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.576 1.55 . . . . 0.0 107.519 177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.19 163.24 35.3 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.555 2.17 . . . . 0.0 111.489 -176.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.256 1.397 0 C-N-CA 123.74 0.816 . . . . 0.0 108.805 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -146.03 136.95 24.46 Favored 'General case' 0 C--O 1.224 -0.274 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 -164.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.05 150.73 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 120.589 1.54 . . . . 0.0 107.95 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.88 151.91 41.56 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.699 1.2 . . . . 0.0 111.013 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 tpp85 -117.68 87.15 2.65 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.651 1.98 . . . . 0.0 106.105 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -57.1 -53.38 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.78 0.8 . . . . 0.0 109.166 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -152.85 -165.93 2.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.009 2.124 . . . . 0.0 106.32 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -78.25 0.41 25.35 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -128.97 -47.74 1.23 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.042 0.937 . . . . 0.0 111.931 -172.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 60.5 m -81.99 135.55 35.35 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 170.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.05 157.69 41.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 165.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -136.31 167.54 21.12 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 168.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CE1' HG21 ' A' ' 44' ' ' VAL . 48.7 p90 -149.2 165.35 32.13 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 175.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -127.53 128.74 46.17 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 3.7 ttt -123.78 117.0 23.91 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.928 1.291 . . . . 0.0 108.28 -170.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.6 m -78.09 153.54 32.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.4 m-85 -58.36 -36.45 73.49 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.329 -0.857 . . . . 0.0 112.171 176.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.94 -29.8 75.76 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-O 119.456 -0.636 . . . . 0.0 112.238 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.47 -37.28 74.25 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.86 1.33 . . . . 0.0 110.474 177.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 33.0 mt -67.1 -48.84 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.803 1.241 . . . . 0.0 109.266 178.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -58.65 -38.98 79.29 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 125.467 1.507 . . . . 0.0 110.954 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.99 -41.12 91.51 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.989 0.899 . . . . 0.0 110.629 -175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.1 mtt85 -67.76 -9.19 41.85 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.174 1.39 . . . . 0.0 111.865 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.3 11.13 82.66 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.692 1.139 . . . . 0.0 113.014 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -86.38 -174.64 5.13 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 166.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -141.33 153.64 45.24 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.112 -0.992 . . . . 0.0 108.344 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -64.73 -28.5 69.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -167.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -87.19 -44.68 11.3 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -57.32 -35.77 70.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 112.95 -171.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.23 -55.8 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.895 1.278 . . . . 0.0 109.344 168.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -76.63 -14.16 60.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -119.87 6.52 10.9 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.899 0.88 . . . . 0.0 112.517 -167.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -129.0 86.22 2.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 170.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -52.27 -35.1 49.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -163.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -31.83 40.58 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.09 0.556 . . . . 0.0 111.672 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -79.94 -16.32 55.51 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.175 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.16 -50.58 72.6 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 167.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -54.62 -31.99 58.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -168.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.3 mm-40 -59.19 -36.23 74.98 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.016 1.326 . . . . 0.0 111.228 -177.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -57.84 10.94 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.32 1.048 . . . . 0.0 108.701 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -63.03 -34.19 77.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.153 0.981 . . . . 0.0 110.454 -173.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -62.88 -35.89 81.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.503 -0.76 . . . . 0.0 112.516 173.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.98 -43.71 70.91 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 120.091 1.314 . . . . 0.0 110.522 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.445 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.98 -37.99 70.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 O-C-N 121.163 -0.96 . . . . 0.0 111.526 -178.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 19.5 tpp -62.74 -39.72 94.99 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.064 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -57.84 -38.61 75.96 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 120.171 1.35 . . . . 0.0 111.561 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.92 -9.96 2.18 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.658 1.583 . . . . 0.0 113.541 173.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.2 t -129.27 -9.25 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 126.3 1.84 . . . . 0.0 110.54 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.03 -28.25 69.96 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.843 -1.161 . . . . 0.0 113.984 -157.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -60.7 -16.09 35.77 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.745 0.702 . . . . 0.0 112.396 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -114.14 6.79 16.44 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.167 1.787 . . . . 0.0 110.803 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -132.73 -18.33 2.43 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.886 1.274 . . . . 0.0 112.557 -172.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.9 -23.17 60.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.567 1.076 . . . . 0.0 112.993 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -98.75 5.6 47.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.8 1.64 . . . . 0.0 111.82 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.17 -15.72 2.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.067 1.347 . . . . 0.0 112.927 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.75 3.04 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 120.282 1.401 . . . . 0.0 113.697 173.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -57.16 -19.7 21.96 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.241 1.017 . . . . 0.0 113.077 155.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -107.97 -177.84 22.18 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.233 1.397 . . . . 0.0 111.762 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.02 170.16 19.6 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.614 2.876 . . . . 0.0 112.803 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.6 tp -144.32 153.76 42.33 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.121 1.768 . . . . 0.0 106.499 169.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -142.0 151.6 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.679 1.592 . . . . 0.0 107.05 -173.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.449 HG23 HG12 ' A' ' 75' ' ' VAL . 4.3 mm -139.27 139.22 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -170.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.22 167.53 22.2 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.793 1.237 . . . . 0.0 109.439 161.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.1 p -144.23 160.16 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.503 0.721 . . . . 0.0 109.864 -169.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -131.31 146.23 52.21 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 127.088 2.155 . . . . 0.0 105.574 163.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.66 129.92 55.34 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 167.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.405 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -118.7 -169.97 1.82 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 127.083 2.153 . . . . 0.0 108.272 -169.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.24 -43.2 96.28 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.9 mmtp -142.09 25.3 1.93 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.705 1.202 . . . . 0.0 112.367 -177.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -174.49 -170.52 37.78 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mp -135.53 143.54 45.8 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.889 1.276 . . . . 0.0 108.454 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.405 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.4 mt-10 -93.14 141.23 28.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 161.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -127.88 128.4 69.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -117.13 134.59 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 103.955 -2.609 . . . . 0.0 103.955 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.449 HG12 HG23 ' A' ' 62' ' ' ILE . 9.6 m -132.55 134.96 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.2 p -132.34 174.75 9.91 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.682 0.793 . . . . 0.0 110.573 -155.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -131.99 170.55 14.76 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 124.714 1.205 . . . . 0.0 111.566 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.73 171.99 7.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.959 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -134.06 166.94 21.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.701 1.6 . . . . 0.0 108.447 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.9 tp -134.49 32.34 3.35 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.491 1.117 . . . . 0.0 110.355 -172.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 m -74.72 45.03 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.833 1.653 . . . . 0.0 111.787 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -60.03 -21.18 61.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.388 1.075 . . . . 0.0 112.41 177.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -135.83 152.33 50.95 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 161.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.5 tp -162.24 -34.89 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.806 1.643 . . . . 0.0 109.768 -172.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -68.56 -38.01 80.39 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.116 0.566 . . . . 0.0 111.549 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -94.1 167.72 11.39 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.518 0.675 . . . . 0.0 109.225 167.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.3 tp -145.6 157.77 43.93 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.461 1.104 . . . . 0.0 109.485 -168.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.42 159.2 71.54 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.309 1.444 . . . . 0.0 107.769 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.89 164.92 32.49 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.646 2.231 . . . . 0.0 111.425 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 . . . . . 0 C--O 1.255 1.385 0 C-N-CA 123.786 0.834 . . . . 0.0 109.74 172.893 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ptm . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -130.02 130.22 44.68 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.457 1.503 . . . . 0.0 106.988 -169.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -122.63 153.1 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.967 1.258 . . . . 0.0 108.93 -171.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -142.18 151.73 42.48 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.931 1.292 . . . . 0.0 110.797 173.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -113.88 90.21 3.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.22 1.808 . . . . 0.0 106.504 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.5 mm -58.84 -53.03 53.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.981 0.896 . . . . 0.0 109.03 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -152.58 -166.97 2.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.488 2.315 . . . . 0.0 105.54 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -77.44 1.34 19.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.814 -1.179 . . . . 0.0 113.868 -173.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -129.94 -50.5 1.13 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.436 1.094 . . . . 0.0 111.116 -168.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 76.8 m -82.25 137.55 34.84 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.7 m -128.57 157.72 41.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.855 -1.906 . . . . 0.0 105.855 165.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -133.28 166.98 21.23 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 166.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.0 162.95 39.37 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -124.9 139.62 53.67 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.1 ttt -138.89 103.27 4.76 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -167.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.2 m -64.22 149.79 47.21 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.427 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.8 m-85 -55.13 -32.65 62.22 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -81.36 -11.66 83.05 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.573 -1.126 . . . . 0.0 113.426 -178.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.27 -42.96 82.98 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 120.169 1.984 . . . . 0.0 108.916 167.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -64.08 -45.4 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.13 1.372 . . . . 0.0 108.998 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 122.508 0.323 . . . . 0.0 111.531 -176.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.33 -40.64 97.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.718 0.771 . . . . 0.0 111.251 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtt-85 -65.9 -14.59 61.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 114.86 -1.063 . . . . 0.0 110.925 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.63 9.67 80.87 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 124.959 1.266 . . . . 0.0 112.762 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -83.61 -178.38 7.01 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 171.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -134.24 147.61 50.71 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -58.41 -31.1 67.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.431 -176.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -83.38 -47.14 11.76 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 173.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.05 -35.95 69.95 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.727 0.811 . . . . 0.0 112.522 -172.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -43.9 -55.82 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.465 1.106 . . . . 0.0 109.386 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -75.49 -16.26 60.32 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -172.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -116.92 7.7 13.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.748 0.819 . . . . 0.0 112.68 -166.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -136.51 88.9 2.41 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -48.95 -45.38 41.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -70.73 -30.79 67.41 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.617 -0.677 . . . . 0.0 111.007 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -78.42 -20.66 50.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.765 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.71 -49.3 71.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 167.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -53.49 -34.82 59.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.965 1.306 . . . . 0.0 112.68 -169.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.413 ' H ' ' HG2' ' A' ' 39' ' ' GLU . 1.9 mm-40 -58.19 -33.96 69.84 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.719 1.208 . . . . 0.0 111.389 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -54.07 51.02 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HA ' HG22 ' A' ' 44' ' ' VAL . 73.9 m-85 -67.15 -36.59 82.17 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.029 0.932 . . . . 0.0 110.263 -173.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 m95 -57.37 -36.48 71.29 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.153 -0.927 . . . . 0.0 112.167 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -68.63 -42.48 77.98 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.464 1.484 . . . . 0.0 111.085 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' A' ' 41' ' ' PHE . 13.5 m -75.19 -38.33 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 120.935 -1.103 . . . . 0.0 111.477 -175.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.8 mmt -59.98 -42.76 94.86 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.935 -0.555 . . . . 0.0 109.954 168.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.87 -41.25 82.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.045 0.839 . . . . 0.0 111.532 176.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -59.61 -9.34 2.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.373 1.869 . . . . 0.0 112.806 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -123.81 -8.33 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.25 1.82 . . . . 0.0 110.059 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -58.91 -28.08 65.86 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -163.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.38 -15.04 62.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.482 1.037 . . . . 0.0 112.462 177.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -112.3 -40.85 4.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.812 1.645 . . . . 0.0 109.236 174.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.73 -26.1 65.37 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.51 1.124 . . . . 0.0 112.118 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -57.5 -24.03 53.54 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.079 1.309 . . . . 0.0 112.569 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -78.83 -14.04 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.736 0.815 . . . . 0.0 112.09 176.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.21 8.57 2.47 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -164.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.16 69.1 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.936 1.35 . . . . 0.0 109.759 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -156.88 30.46 0.31 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.757 1.223 . . . . 0.0 110.088 -172.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 -179.88 37.84 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.373 0.987 . . . . 0.0 111.117 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.58 172.06 15.07 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.903 3.069 . . . . 0.0 112.317 -174.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 25.6 tp -135.93 154.32 51.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.404 1.482 . . . . 0.0 107.154 169.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -143.35 149.69 38.1 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.628 1.571 . . . . 0.0 107.256 -171.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mm -134.81 144.07 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.253 0.933 . . . . 0.0 109.728 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -138.57 150.54 46.43 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.638 1.975 . . . . 0.0 107.073 165.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.12 158.35 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.092 -1.005 . . . . 0.0 109.077 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.75 151.82 43.23 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 157.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.63 145.1 26.62 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 mp -124.27 -172.46 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.762 2.825 . . . . 0.0 107.714 -174.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.38 -37.84 84.87 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -167.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.7 mmtm -140.97 25.43 2.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.337 1.055 . . . . 0.0 112.569 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.76 -168.82 37.29 Favored Glycine 0 C--O 1.228 -0.255 0 O-C-N 120.98 -1.075 . . . . 0.0 110.551 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mp -135.01 145.34 47.99 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.729 1.211 . . . . 0.0 108.98 177.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -97.98 128.53 44.6 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 162.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.08 128.77 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.58 142.05 23.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 173.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.53 136.71 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 171.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.4 p -128.21 174.57 9.16 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.179 0.992 . . . . 0.0 110.113 -160.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -130.5 178.65 6.45 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.969 1.308 . . . . 0.0 110.173 170.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.45 8.78 2.56 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.154 1.381 . . . . 0.0 113.887 -175.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -60.12 143.53 52.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.937 0.895 . . . . 0.0 110.301 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.75 148.05 51.79 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 170.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -14.98 19.08 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.893 1.277 . . . . 0.0 114.366 -177.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -55.09 -32.85 62.3 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.754 -1.216 . . . . 0.0 111.102 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -71.2 7.43 1.28 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.068 1.347 . . . . 0.0 113.381 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.7 mt -135.3 -39.31 0.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.599 1.96 . . . . 0.0 109.177 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.16 -39.5 86.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.988 0.915 . . . . 0.0 112.097 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -64.77 141.1 58.89 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.411 0.55 . . . . 0.0 110.26 177.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.26 165.32 20.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.56 0.744 . . . . 0.0 109.517 173.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.1 m -135.58 160.92 65.93 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.32 1.448 . . . . 0.0 108.499 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.86 155.11 15.14 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.939 3.093 . . . . 0.0 113.195 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 . . . . . 0 C--O 1.252 1.212 0 CA-C-N 115.45 -0.795 . . . . 0.0 108.965 171.308 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptm . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 120.297 0.094 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -133.67 127.89 33.86 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 -170.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.1 mm -125.64 151.05 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.583 1.553 . . . . 0.0 107.957 -174.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -146.0 151.03 37.11 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.345 1.058 . . . . 0.0 110.885 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -112.4 101.98 10.14 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.333 1.853 . . . . 0.0 106.29 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.3 mm -70.17 -55.93 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -177.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -159.22 -170.5 3.01 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.141 1.376 . . . . 0.0 109.702 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.85 -15.74 5.35 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.206 1.403 . . . . 0.0 114.07 -175.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -124.72 -40.77 2.17 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.976 0.911 . . . . 0.0 111.468 -171.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -98.62 139.36 34.44 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 122.161 0.982 . . . . 0.0 109.305 -173.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -124.05 162.12 25.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 165.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.7 pttt -135.02 168.56 18.9 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.577 -0.702 . . . . 0.0 109.395 160.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 44' ' ' VAL . 45.6 p90 -146.44 168.97 19.85 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -132.33 140.0 48.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -135.28 114.47 12.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -170.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -74.52 154.87 38.47 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.486 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-30 -53.98 -32.14 53.03 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 175.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -90.02 -8.05 67.39 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.257 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -47.65 69.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.973 1.886 . . . . 0.0 107.755 162.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.1 mt -56.85 -47.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.179 1.392 . . . . 0.0 108.546 176.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.96 -36.75 80.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 117.971 0.351 . . . . 0.0 111.74 -176.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -64.12 -41.17 97.34 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.58 0.705 . . . . 0.0 110.581 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.34 -4.02 23.84 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.771 1.228 . . . . 0.0 111.153 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.73 7.82 86.83 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.958 1.266 . . . . 0.0 112.634 173.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -84.18 -172.27 4.07 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 168.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -146.09 152.89 40.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -59.07 -33.27 70.6 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 120.168 1.349 . . . . 0.0 111.913 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.12 -48.14 21.77 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -63.16 -33.99 76.66 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 123.507 0.723 . . . . 0.0 112.51 -170.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.86 -56.74 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.036 0.934 . . . . 0.0 108.539 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -77.17 -33.85 56.46 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 121.849 -0.532 . . . . 0.0 111.57 -171.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -89.46 4.44 49.12 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.229 0.611 . . . . 0.0 111.866 -166.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -139.1 88.6 2.29 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -51.45 -38.94 56.21 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -30.57 59.2 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.586 -0.696 . . . . 0.0 111.189 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -80.56 -15.66 56.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.27 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -51.76 66.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 166.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -55.91 -31.13 62.59 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.546 1.538 . . . . 0.0 112.554 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.93 -38.66 76.32 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.897 1.279 . . . . 0.0 111.543 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.421 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -59.54 -51.01 71.7 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.755 0.822 . . . . 0.0 109.223 176.668 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -65.24 -38.95 91.96 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.622 0.769 . . . . 0.0 110.41 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -60.46 -38.5 84.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 118.781 -0.628 . . . . 0.0 111.556 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -74.4 -33.98 63.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.708 1.14 . . . . 0.0 110.79 -174.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 13' ' ' PHE . 17.8 m -72.67 -43.04 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 119.295 0.952 . . . . 0.0 111.635 175.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.0 mmt -55.05 -45.44 75.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.081 0.552 . . . . 0.0 109.61 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.38 -43.81 92.84 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.451 0.3 . . . . 0.0 111.697 176.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -63.95 -13.24 44.44 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.26 1.424 . . . . 0.0 112.491 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 m -120.84 3.18 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.339 1.056 . . . . 0.0 111.586 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -18.84 63.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -164.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.5 -23.47 65.93 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.351 0.978 . . . . 0.0 111.657 173.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -89.2 -8.13 54.21 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.447 1.099 . . . . 0.0 111.21 175.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -124.15 -18.8 5.77 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.418 1.087 . . . . 0.0 112.327 -162.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.68 -26.16 61.29 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.625 1.102 . . . . 0.0 112.179 177.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -83.73 -7.49 59.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.588 1.155 . . . . 0.0 112.651 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.3 7.92 2.0 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.561 1.144 . . . . 0.0 113.515 -166.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.263 7.6 p -79.04 71.1 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 123.077 1.418 . . . . 0.0 109.374 175.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -161.66 37.77 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.89 1.676 . . . . 0.0 108.972 -172.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.31 -173.56 22.69 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.919 1.247 . . . . 0.0 111.188 -173.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.44 179.58 4.96 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.518 2.812 . . . . 0.0 111.311 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.78 135.62 22.28 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -141.95 149.6 40.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.42 1.088 . . . . 0.0 109.084 -171.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.4 mm -132.59 145.91 33.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.896 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -138.71 92.29 2.61 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.412 1.485 . . . . 0.0 107.541 160.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.54 153.95 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.665 0.786 . . . . 0.0 108.884 166.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 152.13 34.07 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 152.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.38 143.36 32.78 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.672 0.789 . . . . 0.0 110.09 -175.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.52 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -130.12 -178.82 4.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.997 2.519 . . . . 0.0 107.914 -173.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.41 -35.04 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -164.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.486 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.1 mmtm -141.94 27.03 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.44 1.096 . . . . 0.0 112.353 178.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.89 -172.46 42.37 Favored Glycine 0 CA--C 1.519 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 110.801 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -136.72 139.45 41.92 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.515 1.126 . . . . 0.0 109.387 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.52 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 15.1 mt-10 -90.89 143.46 26.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 162.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.43 118.9 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.75 146.93 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 168.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.32 119.29 14.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 -174.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -121.02 165.16 15.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.637 0.653 . . . . 0.0 110.057 -163.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -152.17 167.12 29.58 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.76 1.624 . . . . 0.0 108.655 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.51 103.28 3.93 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -142.25 169.42 17.62 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.792 0.837 . . . . 0.0 110.24 -171.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.1 -29.72 67.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.302 1.041 . . . . 0.0 112.035 -175.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 m -61.99 1.57 0.28 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.685 1.594 . . . . 0.0 114.872 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.72 -30.25 13.38 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.795 0.838 . . . . 0.0 110.451 159.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -122.57 125.27 45.35 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 164.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.4 tp -150.98 -50.23 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.146 0.578 . . . . 0.0 110.31 -175.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -147.11 27.61 1.04 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 122.421 1.105 . . . . 0.0 111.182 -175.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.27 150.29 48.48 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.289 -176.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.35 158.87 30.57 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.423 0.689 . . . . 0.0 109.382 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.9 m -138.57 160.91 61.55 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 125.331 1.452 . . . . 0.0 108.626 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.06 155.71 14.55 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.246 3.297 . . . . 0.0 113.282 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 170.688 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 ptm . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -124.26 77.56 1.57 Allowed 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -158.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 mm -69.61 152.68 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.174 1.39 . . . . 0.0 110.422 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -140.19 149.95 43.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.069 1.747 . . . . 0.0 109.674 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -109.24 107.62 17.93 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.0 mm -73.64 -55.53 12.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.1 p30 -163.34 -175.76 4.42 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.297 1.839 . . . . 0.0 107.373 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.3 -24.32 59.18 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.381 -1.45 . . . . 0.0 113.04 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -102.3 -25.75 13.55 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.944 0.897 . . . . 0.0 111.851 -169.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 75.6 m -128.04 137.07 52.04 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.247 1.022 . . . . 0.0 108.523 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 m -123.44 156.59 29.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 105.505 -2.035 . . . . 0.0 105.505 166.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 pttt -135.51 168.93 18.33 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 161.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -153.71 161.1 42.42 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -110.67 143.98 40.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 166.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -139.45 108.81 6.13 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 152.37 45.48 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.449 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.6 m-85 -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.02 0.528 . . . . 0.0 112.221 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.19 -25.44 69.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.058 -0.857 . . . . 0.0 113.402 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.82 -38.94 80.22 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.301 1.551 . . . . 0.0 109.64 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.2 mt -71.37 -42.27 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 125.016 1.326 . . . . 0.0 108.319 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.27 -39.55 90.8 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.787 1.235 . . . . 0.0 111.458 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -62.96 -42.1 99.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.624 0.726 . . . . 0.0 111.132 -177.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.8 mtt-85 -68.43 -11.52 59.82 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.221 173.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.55 12.34 84.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.613 1.102 . . . . 0.0 113.243 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -82.73 -175.07 5.6 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 167.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -137.2 152.83 50.32 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 170.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.8 ptt-85 -59.04 -27.69 65.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.797 1.239 . . . . 0.0 113.259 -175.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -91.52 -43.75 9.49 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.65 -34.16 70.9 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 124.245 1.018 . . . . 0.0 112.314 -174.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -44.17 -56.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 124.474 1.11 . . . . 0.0 109.128 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -74.62 -34.44 62.8 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.118 0.567 . . . . 0.0 112.06 -172.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -94.14 7.68 44.35 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -168.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -134.73 89.94 2.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -52.38 -37.42 56.29 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -164.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -32.43 58.92 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.775 0.43 . . . . 0.0 111.704 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -76.66 -20.05 57.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.898 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.3 -50.84 70.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 168.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -35.01 62.21 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.92 1.288 . . . . 0.0 112.781 -169.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -58.12 -34.92 70.75 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.371 1.068 . . . . 0.0 111.193 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -54.8 42.62 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.074 0.95 . . . . 0.0 108.707 174.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.401 ' HA ' HG22 ' A' ' 44' ' ' VAL . 78.5 m-85 -64.85 -38.1 89.85 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.115 0.966 . . . . 0.0 110.181 -174.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -60.74 -37.8 83.0 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.344 -0.836 . . . . 0.0 112.584 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.54 -38.39 80.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 120.363 1.438 . . . . 0.0 111.513 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.401 HG22 ' HA ' ' A' ' 41' ' ' PHE . 18.9 m -74.04 -42.01 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 121.008 -1.057 . . . . 0.0 111.677 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.04 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.856 0.462 . . . . 0.0 109.959 168.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.19 -38.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 118.06 0.391 . . . . 0.0 111.788 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.16 -13.14 15.69 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.653 1.181 . . . . 0.0 112.993 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.96 16.05 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 124.98 1.312 . . . . 0.0 111.691 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -23.99 67.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.409 -0.807 . . . . 0.0 112.328 -169.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.53 -25.82 67.54 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -91.45 -44.92 8.83 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.54 0.736 . . . . 0.0 109.261 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -64.97 -26.78 68.44 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 118.314 -0.851 . . . . 0.0 112.187 -172.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -61.31 -9.85 5.96 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 120.338 1.426 . . . . 0.0 112.785 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.68 -0.77 11.74 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.578 1.551 . . . . 0.0 111.9 173.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.97 3.87 1.25 Allowed 'General case' 0 C--N 1.342 0.254 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -166.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.267 7.9 p -81.32 57.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 120.254 1.388 . . . . 0.0 109.664 173.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -83.6 12.59 5.54 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.47 1.108 . . . . 0.0 112.361 -166.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.95 177.34 42.79 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.65 1.119 . . . . 0.0 110.635 -177.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.42 167.53 26.08 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.001 3.134 . . . . 0.0 111.017 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.91 147.98 49.56 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.42 0.629 . . . . 0.0 109.433 171.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -147.79 142.43 26.59 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 128.286 2.634 . . . . 0.0 104.296 173.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.572 HD12 ' N ' ' A' ' 63' ' ' GLN . 0.5 OUTLIER -144.15 152.55 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 120.309 1.413 . . . . 0.0 110.742 -175.225 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.572 ' N ' HD12 ' A' ' 62' ' ' ILE . 46.0 tt0 -137.83 148.93 45.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.384 1.874 . . . . 0.0 106.697 170.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 p -141.42 160.2 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 O-C-N 120.46 -1.4 . . . . 0.0 109.459 -176.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -142.72 152.19 42.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 158.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.46 141.68 34.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -124.58 -174.84 3.12 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.927 2.491 . . . . 0.0 107.831 -172.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.29 -37.93 82.05 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -166.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 75.1 mmtt -140.45 25.67 2.2 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.339 1.056 . . . . 0.0 111.673 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.53 -170.4 39.08 Favored Glycine 0 C--O 1.227 -0.321 0 O-C-N 121.101 -1.0 . . . . 0.0 110.972 -174.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.16 146.27 44.75 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.803 1.241 . . . . 0.0 108.848 177.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -97.47 129.42 44.66 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 161.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.479 HG23 HD13 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -117.57 128.46 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 105.183 -2.154 . . . . 0.0 105.183 179.718 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -103.56 145.16 13.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 169.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.03 134.87 42.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.5 p -134.02 175.9 9.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.677 0.791 . . . . 0.0 109.82 -164.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.8 mppt? -138.42 171.88 13.72 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.517 1.527 . . . . 0.0 108.644 171.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 178.79 0.23 Allowed 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.778 1.231 . . . . 0.0 111.371 174.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 55.88 45.29 24.38 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.943 1.297 . . . . 0.0 110.123 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 39.33 1.48 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.441 1.896 . . . . 0.0 106.894 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 m -134.68 20.51 3.57 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.283 -146.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.48 -34.23 66.73 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.308 0.643 . . . . 0.0 110.646 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -139.07 125.48 20.4 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 163.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.0 tp -130.55 -28.28 2.07 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.903 1.281 . . . . 0.0 110.378 -170.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -63.89 -21.46 66.47 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.317 0.647 . . . . 0.0 111.709 165.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.256 69.9 mmtt 52.7 54.0 11.27 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.025 1.73 . . . . 0.0 110.139 -166.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.7 pp -56.98 160.04 3.8 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.26 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.87 160.23 65.47 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 108.732 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.27 156.77 12.74 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.148 3.232 . . . . 0.0 113.193 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 65.5 mtp85 . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.926 1.69 . . . . 0.0 107.85 177.061 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -139.78 78.72 1.68 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -145.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 mm -67.6 153.69 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 124.142 0.977 . . . . 0.0 109.404 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.92 152.65 42.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.731 1.613 . . . . 0.0 110.303 172.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.5 tpp85 -114.69 90.95 3.46 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.912 1.685 . . . . 0.0 106.758 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.42 -53.23 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 122.023 0.916 . . . . 0.0 109.019 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -151.45 -168.76 3.18 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.597 2.359 . . . . 0.0 105.558 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -77.84 5.18 10.1 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.084 -1.01 . . . . 0.0 113.69 -172.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -130.68 -55.14 1.07 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.289 1.036 . . . . 0.0 110.682 -171.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -77.38 138.6 39.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 171.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -125.36 160.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 166.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.2 pttt -134.29 168.95 17.95 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 160.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.0 142.42 25.23 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 170.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -94.05 137.94 32.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 165.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.4 ttt -131.24 116.71 18.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -174.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -76.27 154.06 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.405 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -56.66 -39.06 73.08 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.524 -0.735 . . . . 0.0 112.209 177.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.54 -24.61 73.88 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.763 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -28.63 64.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.083 1.442 . . . . 0.0 110.627 174.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.54 -43.45 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.825 1.25 . . . . 0.0 107.661 178.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.17 -39.58 82.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.565 1.146 . . . . 0.0 111.327 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.13 -45.25 92.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.247 1.019 . . . . 0.0 111.276 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.7 mtt85 -69.03 -6.89 30.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.341 1.056 . . . . 0.0 111.527 172.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.65 12.91 84.03 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.547 1.07 . . . . 0.0 113.194 176.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.69 -174.06 4.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 167.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -139.05 149.69 44.9 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.1 ptt180 -62.38 -31.4 72.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -168.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.54 -44.1 12.95 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 173.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.62 -35.92 68.85 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.309 1.044 . . . . 0.0 112.69 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.1 mm -43.51 -50.98 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 124.791 1.236 . . . . 0.0 110.683 169.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.4 m95 -80.22 -12.95 59.58 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.259 1.024 . . . . 0.0 113.55 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -123.03 7.28 9.24 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -166.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -124.98 99.41 6.12 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 172.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 46.2 ptt85 -60.27 -14.29 17.26 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -163.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -30.37 7.32 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.563 1.545 . . . . 0.0 111.891 178.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -79.53 -14.96 58.51 Favored 'General case' 0 C--N 1.339 0.151 0 O-C-N 121.3 -0.875 . . . . 0.0 111.322 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.5 p -52.19 -57.5 9.45 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.171 0.989 . . . . 0.0 109.533 163.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.48 -32.06 64.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.232 1.813 . . . . 0.0 112.522 -167.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.2 mm-40 -60.01 -34.8 73.84 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.661 1.185 . . . . 0.0 111.219 -176.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -51.94 67.76 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 174.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -66.18 -38.43 88.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.429 0.691 . . . . 0.0 109.924 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -58.34 -37.55 75.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.627 -0.702 . . . . 0.0 112.097 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -64.39 -39.68 94.32 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.022 1.283 . . . . 0.0 111.134 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.8 m -82.47 -39.39 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 O-C-N 121.086 -1.009 . . . . 0.0 112.33 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 mmt -53.14 -47.07 69.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.408 0.683 . . . . 0.0 109.422 166.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.84 -42.0 78.89 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.575 0.625 . . . . 0.0 111.84 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -59.73 -14.86 16.15 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.082 1.353 . . . . 0.0 113.08 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 m -129.76 2.75 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 C-N-CA 124.396 1.078 . . . . 0.0 111.976 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -24.32 67.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -162.143 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.82 -15.94 35.54 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.66 0.664 . . . . 0.0 112.115 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -113.38 3.14 15.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.868 1.667 . . . . 0.0 110.957 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -115.18 -21.34 10.0 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.228 1.411 . . . . 0.0 111.346 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.31 -15.84 18.38 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -176.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -112.67 6.48 18.26 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.003 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -136.37 0.92 2.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.157 1.383 . . . . 0.0 113.217 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -78.29 73.17 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 122.947 1.356 . . . . 0.0 109.415 172.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -153.64 32.42 0.45 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.012 1.325 . . . . 0.0 109.555 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.13 -178.16 35.78 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.084 1.326 . . . . 0.0 110.84 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -71.91 171.15 17.19 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.7 2.933 . . . . 0.0 112.197 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.93 152.08 46.08 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.588 1.555 . . . . 0.0 107.121 171.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -144.11 150.51 38.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.96 1.304 . . . . 0.0 107.683 -168.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mm -135.0 144.72 33.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -172.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.63 170.59 15.56 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 148.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.27 159.6 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.513 -0.742 . . . . 0.0 110.702 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -129.18 145.37 51.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.751 2.42 . . . . 0.0 105.409 167.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.42 132.0 54.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 168.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.14 -169.81 1.86 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.415 2.286 . . . . 0.0 108.496 -170.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.87 -41.84 98.34 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -169.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.0 mmtp -140.11 22.9 2.41 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.697 1.199 . . . . 0.0 112.445 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.19 -168.44 36.38 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mp -135.62 146.77 48.23 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.462 1.505 . . . . 0.0 108.725 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -100.83 122.67 43.81 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 164.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.73 127.25 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -109.93 142.1 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.17 115.14 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -170.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -117.24 171.04 8.22 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.582 0.628 . . . . 0.0 110.435 -163.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -134.73 175.99 9.05 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.237 1.415 . . . . 0.0 109.768 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.64 154.59 28.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.146 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -61.73 140.01 58.25 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 49.2 tp -145.74 130.55 18.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -69.16 -3.85 15.13 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -166.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -56.28 -41.99 76.75 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.176 1.353 . . . . 0.0 109.832 169.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.03 34.63 0.41 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.203 1.001 . . . . 0.0 111.321 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 tt -145.51 -47.52 0.22 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.686 1.995 . . . . 0.0 106.821 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.07 -44.87 95.75 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.215 1.006 . . . . 0.0 111.43 172.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -72.73 138.72 46.73 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -149.33 171.18 16.95 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.264 1.426 . . . . 0.0 110.749 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.69 160.22 68.44 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 124.719 1.208 . . . . 0.0 108.811 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -55.58 159.36 11.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.1 3.2 . . . . 0.0 113.049 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 . . . . . 0 C--O 1.255 1.363 0 C-N-CA 125.891 1.677 . . . . 0.0 107.837 175.361 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.977 0.418 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -127.49 74.97 1.56 Allowed 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 -149.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 mm -69.29 152.56 9.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.106 1.362 . . . . 0.0 110.167 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.64 152.42 45.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.437 1.895 . . . . 0.0 109.869 172.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.9 tpp85 -118.29 91.61 3.61 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.178 1.791 . . . . 0.0 106.185 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.33 -53.38 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.4 p30 -156.92 -166.88 2.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.787 2.035 . . . . 0.0 106.54 175.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.17 2.58 23.68 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.748 -1.22 . . . . 0.0 113.886 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -129.66 -29.2 2.18 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.164 1.386 . . . . 0.0 111.894 -169.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 62.9 m -111.53 133.07 54.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.526 1.53 . . . . 0.0 107.849 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.7 m -122.65 159.25 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 165.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -139.26 172.19 13.18 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 161.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 35.9 p90 -150.49 169.81 20.6 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 169.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -122.5 144.23 49.21 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 167.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -137.48 114.89 11.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 -173.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.24 158.08 35.87 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.3 m-30 -53.01 -39.07 62.87 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.549 -0.72 . . . . 0.0 111.982 172.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.31 -25.74 73.58 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.451 -0.638 . . . . 0.0 113.051 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -34.53 76.55 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.979 1.389 . . . . 0.0 110.027 173.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 32.4 mt -76.88 -43.1 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.843 1.257 . . . . 0.0 107.907 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.83 -40.77 80.84 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.075 1.35 . . . . 0.0 111.397 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.31 -43.37 98.99 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.594 0.758 . . . . 0.0 111.312 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.1 mtt85 -70.85 -7.55 46.29 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.46 174.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 13.0 84.08 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.695 1.141 . . . . 0.0 112.952 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -82.41 -175.02 5.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.427 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.3 t70 -140.1 147.43 40.24 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -54.76 -38.06 66.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.232 0.924 . . . . 0.0 111.04 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -75.6 -45.0 40.09 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.427 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.6 mm-40 -61.1 -38.22 85.54 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.319 -0.863 . . . . 0.0 111.331 -173.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -54.95 -45.49 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 123.796 0.839 . . . . 0.0 109.773 171.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -69.03 -22.68 64.03 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.488 1.04 . . . . 0.0 112.974 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -120.46 3.93 10.73 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -161.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -137.79 82.4 1.92 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -47.7 -42.3 24.63 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -166.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -31.59 63.99 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.66 -0.65 . . . . 0.0 111.417 -178.144 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.57 -20.41 54.09 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.96 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -52.08 64.66 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 166.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.8 -32.33 60.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.303 1.441 . . . . 0.0 113.092 -168.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.92 -37.63 69.18 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.539 1.136 . . . . 0.0 111.671 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.458 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -61.32 -50.08 74.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.493 0.717 . . . . 0.0 109.689 177.573 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -65.16 -38.41 90.47 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.531 0.732 . . . . 0.0 109.573 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -59.87 -34.88 73.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.095 171.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.8 -40.49 69.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 120.622 1.556 . . . . 0.0 110.529 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.4 m -70.88 -41.26 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.258 -0.901 . . . . 0.0 110.927 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.2 mmt -57.95 -42.67 85.43 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.113 0.565 . . . . 0.0 110.49 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.0 -41.3 97.9 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.757 0.708 . . . . 0.0 111.779 176.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -63.37 -13.19 36.69 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.636 1.574 . . . . 0.0 111.864 174.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.5 t -109.66 -5.08 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.983 1.713 . . . . 0.0 109.655 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -56.43 -31.08 63.59 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -161.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.52 -14.67 58.52 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.225 0.92 . . . . 0.0 112.94 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -114.26 -36.9 4.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.99 1.716 . . . . 0.0 109.923 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.87 -28.02 65.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.699 1.199 . . . . 0.0 111.521 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.21 -24.93 57.86 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.405 1.002 . . . . 0.0 112.609 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -83.14 -9.89 58.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.073 0.949 . . . . 0.0 111.983 177.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -135.49 8.64 3.37 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 0.0 113.149 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.6 p -84.68 61.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 123.269 1.509 . . . . 0.0 109.15 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -156.08 31.69 0.34 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.676 1.19 . . . . 0.0 109.457 -171.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -173.87 -177.35 43.01 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.996 1.76 . . . . 0.0 109.328 -172.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.23 173.29 11.61 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.466 2.778 . . . . 0.0 112.116 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.3 tp -138.23 150.06 46.36 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 170.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -142.98 149.73 38.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.547 1.139 . . . . 0.0 107.974 -170.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mm -134.31 144.76 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -171.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -142.9 151.62 41.21 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 162.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.7 p -145.22 158.63 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.455 -1.403 . . . . 0.0 109.821 -166.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -136.32 152.21 50.43 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.58 133.18 49.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 158.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.544 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -123.51 178.26 5.26 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.544 1.938 . . . . 0.0 108.099 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.13 -31.85 70.46 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -165.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.536 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.5 mmtm -140.68 21.81 2.33 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.426 1.09 . . . . 0.0 112.656 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.29 -168.27 36.83 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 120.841 -1.162 . . . . 0.0 111.637 -174.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.7 mp -133.08 138.98 46.91 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.285 1.834 . . . . 0.0 107.4 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.544 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 28.4 mt-10 -94.6 143.95 26.0 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 157.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.6 mt -141.62 121.66 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -107.37 142.6 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.53 129.09 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -134.23 168.5 18.75 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.923 0.783 . . . . 0.0 111.26 -163.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -136.37 168.43 19.46 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 126.047 1.739 . . . . 0.0 109.787 168.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.68 137.08 58.22 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 114.296 -1.32 . . . . 0.0 107.925 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -158.6 159.37 35.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.936 1.295 . . . . 0.0 108.749 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.6 tp -144.2 56.31 1.31 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.203 1.001 . . . . 0.0 108.53 -173.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 m -71.11 35.39 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.735 2.014 . . . . 0.0 113.433 -175.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -64.83 -42.84 94.62 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 120.878 -1.139 . . . . 0.0 109.458 174.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.61 106.69 7.29 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 167.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.5 tp -158.25 -40.68 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -68.85 -27.59 65.95 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -175.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -61.99 147.36 47.3 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 110.826 -177.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.4 158.77 28.47 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.363 0.665 . . . . 0.0 109.529 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.7 m -138.12 161.47 59.35 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 125.259 1.424 . . . . 0.0 108.464 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -53.78 156.35 12.22 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 124.086 3.191 . . . . 0.0 113.348 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.954 1.702 . . . . 0.0 108.073 177.457 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptm . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 110.851 -0.055 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -132.26 127.88 36.66 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -168.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.8 mm -123.77 151.15 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 125.083 1.353 . . . . 0.0 107.976 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -148.31 130.03 15.08 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.595 0.758 . . . . 0.0 110.827 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -88.45 110.78 21.11 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.433 HD11 ' HG2' ' A' ' 12' ' ' LYS . 27.1 mm -74.47 -58.16 5.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.239 0 N-CA-C 108.488 -0.931 . . . . 0.0 108.488 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -157.62 -173.98 4.65 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.605 1.562 . . . . 0.0 108.787 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -56.38 -14.81 3.23 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -174.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -121.09 -46.69 2.31 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.795 1.238 . . . . 0.0 110.879 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.1 m -94.7 142.3 27.61 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.93 0.872 . . . . 0.0 109.621 -172.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.8 m -126.13 163.72 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 166.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.433 ' HG2' HD11 ' A' ' 6' ' ' ILE . 48.2 pttt -134.04 169.13 17.59 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.496 -0.752 . . . . 0.0 109.243 160.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -147.07 167.09 24.96 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 123.831 0.853 . . . . 0.0 108.699 172.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -132.97 143.58 49.55 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 170.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.3 ttt -141.8 112.02 6.93 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -168.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.91 156.06 40.06 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 175.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -55.33 -40.5 71.26 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.389 -0.819 . . . . 0.0 111.978 176.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.86 -12.98 84.08 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 118.612 -1.105 . . . . 0.0 113.769 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.02 -33.74 76.49 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.858 1.829 . . . . 0.0 109.282 166.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.5 mt -77.81 -40.9 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.96 -37.16 81.43 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.207 0.458 . . . . 0.0 111.584 175.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -64.5 -42.43 95.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.87 0.843 . . . . 0.0 111.182 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.6 mtt85 -70.1 -8.02 46.14 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.37 -1.286 . . . . 0.0 111.386 173.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.09 12.81 84.29 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.492 1.044 . . . . 0.0 112.988 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -83.6 -171.87 3.83 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 165.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -139.61 148.17 42.11 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.5 ptt85 -57.96 -31.05 66.49 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 118.77 -0.633 . . . . 0.0 112.064 -177.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -83.1 -46.07 13.23 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.35 -36.46 68.81 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.811 0.844 . . . . 0.0 112.472 -173.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mm -46.03 -48.97 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.508 1.123 . . . . 0.0 110.342 171.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -80.45 -13.35 59.19 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.939 1.088 . . . . 0.0 113.939 -175.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -122.01 10.87 10.19 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.046 0.839 . . . . 0.0 112.731 -166.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -133.63 99.26 4.43 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -58.75 -15.61 12.91 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -164.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.4 -30.83 7.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.463 1.505 . . . . 0.0 111.708 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -78.5 -15.7 58.31 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 118.923 0.783 . . . . 0.0 111.597 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 p -53.56 -60.69 2.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.036 0.935 . . . . 0.0 109.477 164.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -58.46 -29.15 65.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.854 1.662 . . . . 0.0 112.454 -165.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.12 -38.15 73.04 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.728 1.211 . . . . 0.0 111.394 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.424 ' C ' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.2 -55.59 32.96 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.164 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -63.02 -35.98 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.565 1.146 . . . . 0.0 110.635 -175.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.7 m95 -63.8 -38.4 90.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.686 -1.149 . . . . 0.0 112.018 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -68.62 -45.54 71.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.737 1.608 . . . . 0.0 109.868 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.6 -45.97 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 O-C-N 121.489 -0.757 . . . . 0.0 110.581 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.5 tpp -61.85 -37.05 83.04 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.868 -0.52 . . . . 0.0 109.946 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -64.92 -41.86 95.19 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.074 0.852 . . . . 0.0 111.511 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.96 -41.48 98.04 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.549 1.14 . . . . 0.0 110.186 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.7 t -73.5 -16.87 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.685 1.194 . . . . 0.0 111.174 176.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -58.15 -26.31 62.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.68 1.582 . . . . 0.0 115.22 -157.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -58.9 -22.71 60.01 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.608 1.095 . . . . 0.0 112.122 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -95.16 -2.14 50.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.326 1.45 . . . . 0.0 111.615 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -134.09 -16.73 2.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.361 1.065 . . . . 0.0 112.567 -161.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.82 -17.43 36.07 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.447 1.099 . . . . 0.0 113.44 -178.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -107.17 3.69 25.96 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.703 1.601 . . . . 0.0 111.684 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.54 18.75 2.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.43 1.492 . . . . 0.0 112.14 -175.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.3 p -92.07 73.26 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.856 1.312 . . . . 0.0 107.694 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -152.96 31.78 0.49 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.004 -172.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.72 -179.22 37.16 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.061 1.315 . . . . 0.0 110.467 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -71.83 170.32 19.06 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.521 2.814 . . . . 0.0 112.001 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 49.1 mt -135.45 155.53 50.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.501 1.52 . . . . 0.0 107.731 171.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -150.62 147.22 27.14 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.441 1.497 . . . . 0.0 107.201 -162.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 8.4 mm -131.81 141.27 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -136.73 88.89 2.4 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.706 1.602 . . . . 0.0 106.798 167.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.21 154.41 8.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 166.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.66 152.3 33.78 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 152.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.0 143.36 33.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 109.617 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.527 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -129.51 -175.83 3.71 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 127.947 2.499 . . . . 0.0 107.898 -171.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.0 -38.25 82.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -164.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.47 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.8 mmtm -142.3 28.15 1.69 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.557 1.143 . . . . 0.0 111.746 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.13 -172.61 41.04 Favored Glycine 0 CA--C 1.517 0.165 0 O-C-N 121.14 -0.975 . . . . 0.0 110.876 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.58 139.77 44.12 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 124.392 1.077 . . . . 0.0 109.447 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.527 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 18.9 mt-10 -90.79 145.74 24.54 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 161.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.0 mt -134.97 122.59 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 106.789 -1.559 . . . . 0.0 106.789 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -93.99 146.57 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 169.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.7 118.24 11.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 -171.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -124.55 173.87 8.19 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.81 0.732 . . . . 0.0 111.44 -159.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -135.9 173.69 11.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.179 1.392 . . . . 0.0 109.972 165.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.42 148.82 51.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.4 164.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -134.4 34.27 3.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.517 1.127 . . . . 0.0 109.457 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp 48.02 44.55 18.89 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.582 1.553 . . . . 0.0 109.559 -166.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -69.45 -8.61 48.36 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -154.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -56.11 -37.67 69.74 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.767 -1.208 . . . . 0.0 110.1 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -72.95 4.04 4.66 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.874 1.27 . . . . 0.0 112.943 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.7 mt -121.88 -35.55 3.17 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.954 1.702 . . . . 0.0 109.564 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -67.01 -43.11 83.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.717 0.807 . . . . 0.0 110.522 168.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -76.72 156.92 32.12 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-O 121.023 0.44 . . . . 0.0 109.912 170.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.8 tp -149.91 157.55 43.29 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.902 0.881 . . . . 0.0 109.713 -167.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.6 m -138.15 161.56 58.78 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.014 1.326 . . . . 0.0 108.683 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.92 157.14 13.66 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.087 3.191 . . . . 0.0 113.235 175.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.243 0 C-N-CA 124.008 0.923 . . . . 0.0 108.666 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.551 0.204 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -135.62 130.88 35.07 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 125.418 1.487 . . . . 0.0 106.998 -170.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.8 mm -122.39 152.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.51 1.524 . . . . 0.0 108.646 -173.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -143.92 149.29 36.63 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.21 1.404 . . . . 0.0 110.617 169.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -112.5 102.4 10.51 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.7 mm -70.98 -55.3 14.53 Favored 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.2 p30 -163.03 -170.39 2.31 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.99 1.716 . . . . 0.0 107.863 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.19 -20.05 63.77 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.729 -1.232 . . . . 0.0 112.509 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -108.25 -30.4 8.38 Favored 'General case' 0 CA--C 1.522 -0.103 0 O-C-N 121.136 -0.977 . . . . 0.0 111.606 -163.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.6 m -123.1 138.72 54.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.788 1.235 . . . . 0.0 108.755 -178.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -125.92 157.25 35.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 162.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -135.38 167.45 21.02 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 166.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.544 ' CE1' HG21 ' A' ' 44' ' ' VAL . 55.2 p90 -152.68 167.95 27.27 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -130.31 137.07 49.76 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 tpt -132.88 106.76 7.9 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -168.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -68.4 156.29 38.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 175.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.46 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.6 m-85 -55.66 -37.02 67.73 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.487 -0.758 . . . . 0.0 111.425 173.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.05 -32.33 83.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.371 -0.683 . . . . 0.0 112.723 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -40.17 85.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.173 1.486 . . . . 0.0 110.05 177.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 31.6 mt -67.0 -49.28 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.827 1.251 . . . . 0.0 109.116 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -59.63 -38.18 80.65 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 126.042 1.737 . . . . 0.0 111.293 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.76 -40.2 91.82 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.034 0.921 . . . . 0.0 110.521 -175.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -70.57 -7.95 47.85 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.282 -1.326 . . . . 0.0 111.611 173.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.42 10.31 84.72 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.926 1.25 . . . . 0.0 113.234 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -84.04 -178.5 6.99 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 168.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.47 151.14 45.96 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.024 -1.047 . . . . 0.0 108.562 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -62.95 -31.22 72.27 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -166.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.54 -42.37 13.58 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -60.53 -34.82 74.67 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 123.729 0.812 . . . . 0.0 112.175 -172.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.4 mm -41.75 -57.26 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.418 1.087 . . . . 0.0 109.137 167.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.411 ' CZ2' HG21 ' A' ' 64' ' ' VAL . 63.0 m95 -73.17 -38.68 66.1 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.821 0.449 . . . . 0.0 111.664 -173.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -89.34 4.14 49.88 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -169.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -130.74 84.31 2.18 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -51.6 -41.87 61.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.394 -0.816 . . . . 0.0 112.687 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -28.48 66.71 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.49 -0.756 . . . . 0.0 111.712 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -81.61 -18.45 44.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.417 -0.802 . . . . 0.0 111.299 175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.33 -46.69 85.47 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 163.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.537 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 8.6 tt0 -53.89 -32.91 54.96 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.213 1.005 . . . . 0.0 113.415 -171.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.427 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 1.0 OUTLIER -67.25 -32.71 73.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.422 1.489 . . . . 0.0 111.028 -176.326 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -47.34 85.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 1.4 m-30 -68.97 -43.31 75.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.295 1.038 . . . . 0.0 109.521 -173.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -54.91 -39.47 68.83 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.471 -0.776 . . . . 0.0 111.533 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.8 -39.2 90.7 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.557 1.071 . . . . 0.0 111.333 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.544 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.5 m -78.39 -39.19 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.002 -1.061 . . . . 0.0 112.02 -174.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.5 mmm -55.32 -48.11 74.63 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.3 -38.23 79.72 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.39 -16.57 9.48 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.439 1.495 . . . . 0.0 112.733 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 m -135.87 12.01 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 125.386 1.474 . . . . 0.0 111.117 -173.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -21.45 62.59 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -160.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -58.71 -28.34 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.996 0.918 . . . . 0.0 111.254 174.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -90.63 3.15 54.94 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.363 1.465 . . . . 0.0 111.327 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -134.31 -24.81 1.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 O-C-N 121.237 -0.914 . . . . 0.0 112.822 -161.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -57.28 -22.93 45.02 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.106 0.963 . . . . 0.0 113.134 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -95.53 4.52 53.11 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.115 1.366 . . . . 0.0 112.359 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.25 -24.46 2.07 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.444 1.098 . . . . 0.0 113.153 -175.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -73.43 1.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 120.142 1.337 . . . . 0.0 113.336 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -56.7 -18.53 12.69 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.123 1.369 . . . . 0.0 113.366 156.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.57 -173.44 23.04 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.433 1.492 . . . . 0.0 111.911 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.46 171.69 12.57 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.421 2.747 . . . . 0.0 111.832 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.434 HD13 ' H ' ' A' ' 61' ' ' TRP . 0.1 OUTLIER -137.98 152.1 48.58 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.346 1.459 . . . . 0.0 107.442 175.729 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.434 ' H ' HD13 ' A' ' 60' ' ' LEU . 95.3 m95 -147.85 145.04 28.55 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 125.598 1.559 . . . . 0.0 107.615 -164.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -133.79 141.28 44.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -138.24 159.39 42.17 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.77 2.028 . . . . 0.0 107.27 167.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.411 HG21 ' CZ2' ' A' ' 31' ' ' TRP . 7.1 p -146.87 162.53 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 120.553 -1.342 . . . . 0.0 110.968 -170.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.36 149.01 52.44 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 126.862 2.065 . . . . 0.0 106.041 160.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.07 129.59 55.47 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 167.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.421 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 5.0 mp -118.9 -175.3 2.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 108.319 -170.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.28 -35.52 80.61 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -166.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.5 mmtm -141.42 23.93 2.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.346 1.059 . . . . 0.0 112.124 -178.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.05 -171.4 40.58 Favored Glycine 0 N--CA 1.454 -0.138 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mp -136.77 143.08 43.04 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.432 1.093 . . . . 0.0 108.341 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.421 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.5 mt-10 -90.25 141.46 28.69 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 161.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.405 HD12 ' C ' ' A' ' 72' ' ' GLU . 0.7 OUTLIER -127.98 132.36 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 175.197 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -112.5 139.05 39.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 104.406 -2.442 . . . . 0.0 104.406 177.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.26 142.22 41.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 119.302 0.955 . . . . 0.0 109.935 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -136.86 170.86 15.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.411 0.684 . . . . 0.0 110.193 -159.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -137.66 154.63 49.67 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.862 1.265 . . . . 0.0 108.9 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.75 -25.57 66.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -168.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -64.97 -32.7 74.54 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.217 -178.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 34.07 46.89 0.17 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.938 2.495 . . . . 0.0 114.736 168.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.6 m 55.85 20.49 4.16 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.923 1.689 . . . . 0.0 114.75 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -59.83 -44.49 94.03 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 120.934 -1.104 . . . . 0.0 108.376 167.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -77.09 34.24 0.15 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.737 1.615 . . . . 0.0 111.619 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt -143.74 -46.19 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.519 1.927 . . . . 0.0 107.07 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.69 -45.77 92.92 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 169.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -74.35 135.55 42.48 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 165.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.1 159.18 31.44 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.908 0.883 . . . . 0.0 110.057 -178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.9 m -136.73 158.57 72.84 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 125.16 1.384 . . . . 0.0 108.652 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.23 164.51 30.99 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.742 2.294 . . . . 0.0 111.194 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 57.3 mtm180 . . . . . 0 C--O 1.253 1.244 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 171.015 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.498 1.963 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -130.2 127.06 38.9 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -170.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 mm -121.55 150.43 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.876 1.27 . . . . 0.0 108.861 -170.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -146.45 150.4 35.55 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.047 1.339 . . . . 0.0 109.923 172.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.17 99.83 6.27 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -179.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -71.1 -56.09 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -168.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.0 p30 -156.27 -168.09 2.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.476 1.51 . . . . 0.0 108.376 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.4 -17.1 58.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -117.3 -53.65 2.43 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.166 -0.959 . . . . 0.0 109.671 -167.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 44.9 m -86.55 138.06 32.02 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.81 0.844 . . . . 0.0 109.48 177.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.5 m -131.65 158.98 43.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 165.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -144.32 170.38 16.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.933 -1.105 . . . . 0.0 109.975 170.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.434 ' CE1' HG21 ' A' ' 44' ' ' VAL . 53.7 p90 -151.93 167.76 27.33 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.238 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -128.92 141.08 51.39 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 173.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.4 ttt -140.8 105.67 4.95 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -167.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.1 m -65.79 149.86 49.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.427 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.2 m-85 -55.88 -32.89 64.1 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.5 -7.58 81.98 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 118.572 -1.126 . . . . 0.0 113.362 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -66.87 -49.04 66.92 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.26 2.03 . . . . 0.0 107.958 164.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.36 -46.43 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.197 1.399 . . . . 0.0 108.855 177.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.71 -36.29 80.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.328 0.251 . . . . 0.0 111.397 -176.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.39 -40.69 85.69 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.493 0.717 . . . . 0.0 111.027 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.7 mtp85 -64.07 -14.97 58.4 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.988 -1.005 . . . . 0.0 111.703 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.05 7.19 80.94 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.33 -0.705 . . . . 0.0 113.18 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -80.45 -174.88 4.87 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 166.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -138.79 148.4 43.77 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -59.08 -30.68 68.25 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.595 0.634 . . . . 0.0 112.469 -174.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -82.69 -48.78 10.5 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.33 -36.61 66.44 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.989 0.916 . . . . 0.0 112.919 -171.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -44.29 -54.76 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 124.391 1.076 . . . . 0.0 109.354 170.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -76.95 -11.96 59.88 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -121.76 7.24 9.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.695 0.798 . . . . 0.0 112.84 -167.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -136.66 87.04 2.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.473 -2.047 . . . . 0.0 105.473 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -51.12 -38.14 50.13 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -164.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.28 -32.13 58.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.614 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -79.53 -18.1 52.6 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.286 176.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -48.99 75.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 166.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -53.27 -34.74 58.49 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.292 1.437 . . . . 0.0 112.696 -169.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.424 ' H ' ' HG2' ' A' ' 39' ' ' GLU . 2.1 mm-40 -59.26 -32.98 70.5 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.377 1.471 . . . . 0.0 111.315 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.409 HD21 ' CE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -58.2 -57.84 11.09 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.418 1.087 . . . . 0.0 108.328 173.174 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HA ' HG22 ' A' ' 44' ' ' VAL . 75.9 m-85 -63.98 -36.73 84.94 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.848 1.259 . . . . 0.0 110.918 -172.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -56.11 -44.23 78.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.778 172.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.23 -41.54 76.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.498 1.045 . . . . 0.0 111.279 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.434 HG21 ' CE1' ' A' ' 13' ' ' PHE . 17.6 m -70.96 -43.21 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 121.217 -0.927 . . . . 0.0 111.389 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 50.5 tpp -56.8 -43.28 80.78 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 123.621 0.768 . . . . 0.0 109.056 172.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.55 -40.26 94.05 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.457 -0.777 . . . . 0.0 111.925 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.72 -9.45 9.25 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.604 1.561 . . . . 0.0 112.896 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.451 HG23 ' HG3' ' A' ' 52' ' ' GLU . 22.6 m -128.92 6.21 2.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 C-N-CA 124.614 1.166 . . . . 0.0 111.431 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -26.31 64.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -164.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -60.23 -22.79 63.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.986 0.914 . . . . 0.0 112.209 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -103.94 -3.23 25.0 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.167 1.387 . . . . 0.0 111.372 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.451 ' HG3' HG23 ' A' ' 48' ' ' VAL . 77.6 mm-40 -121.61 -14.8 8.11 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.222 1.009 . . . . 0.0 112.097 -169.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.64 -25.59 53.83 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.126 0.876 . . . . 0.0 112.746 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -76.24 -21.45 56.35 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.764 0.826 . . . . 0.0 112.351 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -127.21 -2.35 6.35 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 124.731 1.212 . . . . 0.0 113.646 -162.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.7 p -77.48 64.6 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 123.24 1.495 . . . . 0.0 110.329 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -159.97 35.92 0.18 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.302 1.441 . . . . 0.0 108.877 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.1 -175.93 33.64 Favored Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.819 1.676 . . . . 0.0 110.377 -173.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.28 172.22 11.5 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.53 2.82 . . . . 0.0 111.442 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.4 tp -137.79 150.62 47.36 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 173.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -143.02 147.03 34.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.075 1.35 . . . . 0.0 107.538 -170.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.9 mm -132.18 144.85 35.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -136.22 154.51 50.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.071 1.748 . . . . 0.0 106.612 162.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -140.03 160.38 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 O-C-N 121.014 -1.053 . . . . 0.0 109.801 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.76 147.25 52.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.862 2.065 . . . . 0.0 105.519 162.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.53 128.47 55.21 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 167.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.429 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -117.76 -172.82 2.31 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.616 2.366 . . . . 0.0 108.021 -169.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.92 -38.58 88.96 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.323 -0.861 . . . . 0.0 113.303 -166.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.4 mmtm -141.34 25.4 2.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.653 1.181 . . . . 0.0 112.298 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.54 -169.44 37.93 Favored Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mp -135.78 144.2 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.457 1.103 . . . . 0.0 108.437 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.429 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 26.1 mt-10 -92.61 140.6 29.38 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 160.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.403 HD12 ' C ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -128.47 127.9 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 104.443 -2.428 . . . . 0.0 104.443 175.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -108.89 143.66 18.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 104.776 -2.305 . . . . 0.0 104.776 176.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 131.7 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 -172.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -135.31 167.96 20.07 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.619 0.645 . . . . 0.0 110.206 -167.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -143.4 169.19 18.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.492 1.917 . . . . 0.0 107.726 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.25 163.87 4.67 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 162.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -77.99 61.39 2.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.35 1.06 . . . . 0.0 110.502 177.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 61.0 tp -57.14 -31.02 64.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.46 1.504 . . . . 0.0 111.819 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.8 m -121.15 39.86 3.71 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.596 1.558 . . . . 0.0 109.845 -173.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -51.67 -35.62 43.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.364 1.066 . . . . 0.0 110.603 172.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.9 t0 -128.53 153.25 47.38 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.449 1.5 . . . . 0.0 107.144 164.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.4 tp -157.45 -37.28 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.164 0.986 . . . . 0.0 111.171 -172.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.59 -32.66 71.54 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -92.38 162.88 14.08 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.826 0.822 . . . . 0.0 111.31 -175.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -155.18 138.28 15.57 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -155.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.9 m -138.0 160.38 64.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.279 1.432 . . . . 0.0 108.841 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.3 156.98 12.31 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 124.059 3.173 . . . . 0.0 113.312 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 . . . . . 0 C--O 1.254 1.303 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.352 170.238 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 111.412 0.153 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.28 130.49 44.6 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 125.33 1.452 . . . . 0.0 107.154 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 mm -123.63 151.22 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 120.175 1.352 . . . . 0.0 108.889 -170.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -143.37 151.2 40.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.703 1.601 . . . . 0.0 109.484 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.12 93.5 3.83 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm -66.2 -54.46 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -170.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -155.72 -160.81 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.538 1.535 . . . . 0.0 108.706 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -72.13 -10.96 60.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -175.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -130.74 -40.81 1.2 Allowed 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.273 -0.892 . . . . 0.0 111.686 -166.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.7 m -91.65 132.51 36.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.5 m -135.99 155.94 36.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 164.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.2 pttt -140.4 168.78 18.99 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.29 -0.882 . . . . 0.0 109.82 176.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -149.56 164.67 34.45 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 175.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -125.69 141.21 52.13 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 173.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.7 ttt -139.65 104.95 5.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -167.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -67.04 148.96 51.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-85 -51.83 -42.12 62.31 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.51 -11.88 80.21 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.412 -1.216 . . . . 0.0 113.842 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.9 -41.33 95.69 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.905 1.852 . . . . 0.0 109.214 166.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.3 mt -71.65 -40.98 71.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.179 1.391 . . . . 0.0 108.177 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.52 -35.67 80.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.156 0.435 . . . . 0.0 111.655 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -65.08 -40.46 94.65 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.91 0.862 . . . . 0.0 111.188 -175.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 56.8 mtt-85 -67.02 -15.18 63.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.847 1.259 . . . . 0.0 110.783 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.09 11.18 82.82 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.893 1.235 . . . . 0.0 113.055 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -83.7 -175.31 5.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 170.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -139.04 153.96 48.16 Favored 'General case' 0 CA--C 1.519 -0.231 0 O-C-N 121.247 -0.908 . . . . 0.0 108.566 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.9 ptt-85 -60.74 -29.29 69.3 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.755 1.222 . . . . 0.0 113.611 -172.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -90.6 -42.85 10.55 Favored 'General case' 0 C--O 1.226 -0.17 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -59.04 -34.41 71.89 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.193 0.997 . . . . 0.0 112.776 -174.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -42.25 -58.29 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.532 1.133 . . . . 0.0 109.364 167.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -73.04 -33.3 65.63 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.456 0.702 . . . . 0.0 112.235 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -96.2 4.84 52.13 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -168.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -128.38 88.51 2.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -50.06 -42.9 50.77 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -167.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -30.35 64.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.554 -0.716 . . . . 0.0 111.121 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -79.95 -17.55 52.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.214 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -48.8 76.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 167.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.55 -34.95 62.69 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.216 1.406 . . . . 0.0 112.408 -169.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.06 -34.73 68.55 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.897 1.279 . . . . 0.0 111.525 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -54.71 43.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.492 1.117 . . . . 0.0 108.245 175.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -66.28 -37.7 86.08 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.482 1.113 . . . . 0.0 110.665 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -57.75 -36.75 72.53 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 117.913 -1.041 . . . . 0.0 112.098 172.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -68.56 -42.92 77.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.524 1.511 . . . . 0.0 110.629 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 m -73.01 -41.31 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 121.167 -0.958 . . . . 0.0 111.075 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.2 mmt -59.2 -41.86 89.52 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.38 0.672 . . . . 0.0 110.38 170.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.89 -42.95 98.99 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.576 0.625 . . . . 0.0 111.229 176.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -8.3 15.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.554 1.541 . . . . 0.0 112.031 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.53 -3.82 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.441 1.896 . . . . 0.0 109.566 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -56.71 -28.29 60.69 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -163.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.15 -15.09 59.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.474 1.034 . . . . 0.0 113.047 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -118.68 -31.45 4.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.592 1.157 . . . . 0.0 111.162 169.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.44 -26.65 61.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.078 -1.014 . . . . 0.0 111.316 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.87 -15.56 8.94 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.817 1.19 . . . . 0.0 113.703 175.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -122.59 13.91 10.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.542 1.137 . . . . 0.0 111.721 174.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.34 -1.7 8.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.79 1.236 . . . . 0.0 112.385 171.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.0 p -75.97 68.22 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 124.848 1.259 . . . . 0.0 110.091 167.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -152.96 27.63 0.53 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.162 0.985 . . . . 0.0 110.554 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.73 178.73 46.41 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.975 1.274 . . . . 0.0 110.579 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.45 174.15 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 124.113 3.209 . . . . 0.0 111.818 -178.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -128.37 152.58 48.01 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.873 1.269 . . . . 0.0 107.776 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -140.17 151.22 45.07 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.304 1.842 . . . . 0.0 106.939 -172.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -134.27 144.12 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.949 0.795 . . . . 0.0 109.046 -172.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -137.49 155.6 49.1 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.609 1.963 . . . . 0.0 107.066 164.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.9 p -147.92 156.48 9.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 120.435 -1.415 . . . . 0.0 110.036 -172.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.03 145.77 51.65 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 164.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.49 132.43 51.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.15 -177.56 3.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.931 2.493 . . . . 0.0 107.97 -170.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.87 -36.52 79.42 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -164.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 45.8 mmtm -141.63 27.79 1.84 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.405 1.082 . . . . 0.0 112.01 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.66 -171.99 40.08 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -174.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.86 144.51 41.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.897 1.279 . . . . 0.0 108.384 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -94.52 137.35 33.75 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 161.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -126.52 125.43 67.24 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 N-CA-C 104.993 -2.225 . . . . 0.0 104.993 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.5 142.71 18.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.47 147.13 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 118.475 0.579 . . . . 0.0 109.761 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.26 170.19 16.46 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.173 0.989 . . . . 0.0 110.01 -164.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -134.57 160.9 36.63 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 124.099 0.96 . . . . 0.0 111.225 171.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.03 -21.85 46.3 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.196 -1.365 . . . . 0.0 112.258 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -62.23 -21.94 65.55 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.786 0.834 . . . . 0.0 112.492 -175.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.52 -27.92 66.61 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.448 1.099 . . . . 0.0 112.43 171.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 m -134.88 33.21 3.18 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.689 0.796 . . . . 0.0 112.138 -156.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -56.79 -31.92 65.14 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.711 -0.618 . . . . 0.0 111.749 175.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -144.72 -34.48 0.36 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.529 0.732 . . . . 0.0 111.542 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.0 tp 75.32 -28.28 0.19 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 128.34 2.656 . . . . 0.0 113.54 161.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -67.88 -20.32 65.11 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.318 0.647 . . . . 0.0 111.872 167.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.69 155.31 26.75 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.862 -0.524 . . . . 0.0 110.89 174.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.2 tp -146.34 155.69 42.8 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.04 0.936 . . . . 0.0 110.22 -166.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.8 m -63.49 160.12 45.39 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 123.272 0.629 . . . . 0.0 110.381 171.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.44 159.22 8.68 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.943 3.095 . . . . 0.0 113.167 173.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.498 1.919 . . . . 0.0 106.328 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -124.55 75.71 1.43 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -155.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 mm -65.92 153.04 8.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 125.053 1.341 . . . . 0.0 110.106 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -141.11 151.41 43.92 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.02 1.728 . . . . 0.0 110.118 170.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -114.69 89.85 3.2 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.067 1.747 . . . . 0.0 106.502 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -59.49 -53.28 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 34.6 p-10 -154.13 -166.16 2.29 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.778 2.031 . . . . 0.0 106.413 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.33 0.34 25.88 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 120.937 -1.102 . . . . 0.0 113.337 -174.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -126.59 -53.82 1.45 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 124.337 1.055 . . . . 0.0 110.051 -169.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.1 m -80.48 135.88 36.21 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 169.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.3 m -128.9 156.75 41.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 163.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.5 pttt -136.13 170.98 15.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 168.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.32 150.95 32.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -101.29 145.81 28.37 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 164.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.2 ttt -141.29 105.45 4.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 124.488 1.115 . . . . 0.0 108.195 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -66.4 150.72 48.48 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.479 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.9 m-85 -53.01 -42.63 65.81 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.11 -9.39 84.0 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 119.804 -1.189 . . . . 0.0 113.488 -175.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -66.46 -45.14 80.73 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.796 1.798 . . . . 0.0 108.854 165.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 23.0 mt -65.34 -42.15 93.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 C-N-CA 124.959 1.304 . . . . 0.0 107.706 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -62.73 -38.84 92.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.412 0.551 . . . . 0.0 111.627 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.37 -42.56 83.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.376 0.67 . . . . 0.0 110.574 -177.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.4 mtt85 -67.09 -7.96 26.99 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.14 0.976 . . . . 0.0 112.019 170.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.66 8.37 86.12 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.075 0.845 . . . . 0.0 113.058 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -85.7 -171.11 3.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 168.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -143.2 153.96 43.37 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -62.29 -33.34 74.45 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -167.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.13 -43.27 13.19 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -57.46 -35.26 69.92 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.088 0.955 . . . . 0.0 112.749 -172.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -42.61 -56.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.33 1.052 . . . . 0.0 109.475 168.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -77.04 -14.87 59.77 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.274 1.03 . . . . 0.0 113.681 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -118.66 7.09 11.63 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.874 0.87 . . . . 0.0 112.429 -167.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -130.09 86.65 2.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -50.23 -40.07 46.41 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -165.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -30.73 59.92 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.719 -0.613 . . . . 0.0 111.324 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -79.78 -16.73 54.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.296 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.94 -48.19 79.99 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 168.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -54.8 -33.73 61.85 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.212 1.405 . . . . 0.0 112.457 -170.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.36 -35.34 71.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.679 1.192 . . . . 0.0 111.277 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -55.84 29.19 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.031 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.406 ' HA ' HG22 ' A' ' 44' ' ' VAL . 67.6 m-85 -63.9 -36.48 84.08 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.468 1.107 . . . . 0.0 110.518 -175.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 72.1 m95 -61.21 -40.02 92.41 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.272 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -69.37 -38.13 77.91 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.666 1.575 . . . . 0.0 111.099 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' A' ' 41' ' ' PHE . 18.6 m -74.15 -40.54 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 121.03 -1.044 . . . . 0.0 111.737 178.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.1 tpp -60.79 -39.51 89.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.02 172.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.63 -38.93 75.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.698 1.135 . . . . 0.0 111.638 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.3 -8.07 5.29 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.421 1.488 . . . . 0.0 113.478 174.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.0 t -129.58 -10.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 125.596 1.558 . . . . 0.0 110.879 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.98 -29.83 68.71 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -158.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.92 -16.72 45.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.766 0.712 . . . . 0.0 112.571 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -113.43 8.48 17.89 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.188 1.795 . . . . 0.0 110.893 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -131.4 -17.14 2.99 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 125.138 1.375 . . . . 0.0 111.896 -173.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.68 -16.87 18.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -108.73 5.93 25.2 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.953 1.701 . . . . 0.0 112.006 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.54 -3.89 2.96 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.515 1.526 . . . . 0.0 112.776 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.73 67.24 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 123.156 1.455 . . . . 0.0 110.125 169.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -161.33 39.09 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.612 1.565 . . . . 0.0 108.141 -171.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.68 -174.63 27.63 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 125.727 1.632 . . . . 0.0 110.245 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.27 174.34 9.23 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.7 2.933 . . . . 0.0 111.509 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.4 tp -145.66 147.76 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.868 1.267 . . . . 0.0 108.064 173.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -144.13 147.15 33.33 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.022 1.329 . . . . 0.0 107.807 -175.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.471 HG23 HG12 ' A' ' 75' ' ' VAL . 3.7 mm -139.56 140.86 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -173.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -144.26 169.52 17.73 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.621 1.168 . . . . 0.0 109.583 161.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.2 p -146.65 162.45 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.173 -0.955 . . . . 0.0 109.955 -169.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -133.86 148.07 51.24 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 126.685 1.994 . . . . 0.0 105.631 161.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.38 129.2 55.54 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 166.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -119.47 -177.55 3.4 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.557 2.343 . . . . 0.0 108.1 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.66 -35.95 79.43 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -165.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.479 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.2 mmtm -140.96 26.3 2.06 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.478 1.111 . . . . 0.0 112.073 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.26 -171.42 39.25 Favored Glycine 0 C--O 1.228 -0.22 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 -174.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -137.59 144.96 42.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 125.186 1.394 . . . . 0.0 108.111 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -96.43 140.39 31.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 161.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -126.76 128.08 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.57 134.45 60.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 104.078 -2.564 . . . . 0.0 104.078 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.471 HG12 HG23 ' A' ' 62' ' ' ILE . 3.1 m -131.68 135.04 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -127.56 159.46 34.55 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -161.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -150.17 158.57 44.3 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.025 1.33 . . . . 0.0 108.047 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.29 161.35 16.88 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 163.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -60.88 149.05 37.41 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 171.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.7 tt -139.23 106.36 5.47 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.7 p -66.17 -46.37 77.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.214 1.406 . . . . 0.0 111.782 -177.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.1 tptt 64.66 -41.92 0.29 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.965 2.506 . . . . 0.0 112.374 -166.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.41 141.87 21.66 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 125.977 1.711 . . . . 0.0 107.528 166.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.2 tp -161.0 -41.52 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.676 0.79 . . . . 0.0 110.838 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.33 -34.21 76.86 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -171.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -66.34 141.17 58.07 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.773 0.321 . . . . 0.0 110.455 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.64 160.23 30.53 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.9 m -138.03 157.12 73.61 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.298 1.439 . . . . 0.0 108.068 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -84.42 24.89 0.72 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 124.296 3.331 . . . . 0.0 113.401 -170.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 124.26 1.024 . . . . 0.0 109.095 175.344 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.398 0.142 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -138.12 117.52 12.85 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -162.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 mp -112.76 152.92 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 120.649 1.568 . . . . 0.0 108.223 -177.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -137.17 150.58 48.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.387 1.875 . . . . 0.0 109.239 172.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.25 106.3 15.67 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 173.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 38.4 mm -70.69 -54.77 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -179.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -159.11 -168.19 2.28 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.631 1.572 . . . . 0.0 108.665 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -60.29 -15.77 28.24 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.799 1.24 . . . . 0.0 113.475 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -125.57 -46.64 1.73 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.174 -0.953 . . . . 0.0 111.785 -168.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.3 m -87.45 141.5 28.58 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -128.66 157.57 41.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 164.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -133.81 166.57 22.36 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 164.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.462 ' CE1' HG21 ' A' ' 44' ' ' VAL . 46.7 p90 -151.96 170.8 18.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.332 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -132.77 136.39 46.3 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -129.76 114.36 15.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 -171.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.97 154.63 39.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.477 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.1 m-85 -55.48 -39.02 69.89 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.389 -0.819 . . . . 0.0 111.58 173.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.34 -25.7 72.52 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-O 119.119 -0.823 . . . . 0.0 113.126 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -37.23 81.69 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.402 1.601 . . . . 0.0 109.736 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 71.1 mt -73.74 -43.18 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.07 -39.95 87.82 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.809 1.244 . . . . 0.0 111.7 176.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.89 -42.36 99.75 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.698 0.799 . . . . 0.0 111.145 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.3 mtt85 -68.19 -12.17 60.5 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.37 173.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 12.57 84.05 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.799 1.19 . . . . 0.0 112.829 -177.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -82.02 -177.72 6.72 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 168.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.418 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 9.5 t70 -132.19 146.89 52.33 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 173.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -57.11 -30.37 64.32 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.366 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -82.85 -50.05 9.04 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.933 0.788 . . . . 0.0 109.169 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.1 mm-40 -55.9 -36.0 67.17 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.228 1.011 . . . . 0.0 112.671 -171.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.72 -56.55 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.587 1.155 . . . . 0.0 109.524 169.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -76.04 -13.78 60.22 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -118.38 7.75 12.02 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.585 0.754 . . . . 0.0 112.32 -167.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -137.62 88.25 2.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.04 -2.207 . . . . 0.0 105.04 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -49.85 -42.86 48.38 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -165.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 -32.25 65.59 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 121.594 -0.691 . . . . 0.0 111.016 -178.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -77.56 -18.84 56.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.072 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -55.44 24.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 165.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -52.14 -33.96 42.42 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.498 1.519 . . . . 0.0 113.171 -166.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.426 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 1.8 mm-40 -54.52 -40.59 68.75 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.47 1.108 . . . . 0.0 111.264 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -60.21 -51.29 70.22 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.173 0.989 . . . . 0.0 109.576 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -65.55 -34.61 78.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.019 0.927 . . . . 0.0 110.131 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -62.08 -36.58 82.1 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.613 -1.184 . . . . 0.0 112.446 172.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.36 -46.63 82.58 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 121.082 1.765 . . . . 0.0 110.856 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.51 -41.49 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 121.78 -0.575 . . . . 0.0 110.762 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 tpp -59.68 -41.86 91.64 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.451 0.7 . . . . 0.0 109.715 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -62.02 -42.16 98.87 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.411 -0.805 . . . . 0.0 111.37 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -64.6 -8.43 14.19 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 126.328 1.851 . . . . 0.0 112.211 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.9 m -125.92 4.08 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.761 1.224 . . . . 0.0 111.907 175.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.47 -25.48 66.06 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -163.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -61.46 -23.25 65.73 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.451 1.023 . . . . 0.0 111.78 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -90.89 -7.59 51.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.584 1.154 . . . . 0.0 111.492 177.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.57 -23.59 2.32 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -157.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.34 -27.27 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.52 1.055 . . . . 0.0 112.539 -176.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -79.45 -10.51 59.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.164 0.985 . . . . 0.0 112.376 176.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -131.97 -10.67 3.4 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.461 1.105 . . . . 0.0 113.82 -163.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.8 m -72.59 3.56 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.73 1.605 . . . . 0.0 113.714 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -58.01 -21.21 43.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.426 1.09 . . . . 0.0 113.302 156.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.76 -175.89 38.31 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.889 1.233 . . . . 0.0 112.191 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -72.53 171.24 17.53 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 112.154 -175.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 28.6 tp -142.26 152.11 42.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.506 1.522 . . . . 0.0 106.936 166.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -142.65 152.06 42.07 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.884 1.674 . . . . 0.0 107.087 -173.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mm -135.18 142.35 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -172.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -139.61 153.7 47.41 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.57 2.348 . . . . 0.0 106.36 170.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.7 p -139.81 160.95 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.048 -1.032 . . . . 0.0 109.217 -178.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -133.92 148.06 51.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 161.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.81 128.27 55.7 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.404 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -119.22 -175.06 2.85 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.482 2.313 . . . . 0.0 107.939 -169.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -62.92 -36.75 84.43 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -165.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -141.56 25.02 2.04 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.524 1.13 . . . . 0.0 112.4 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.63 -170.72 38.82 Favored Glycine 0 CA--C 1.518 0.27 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 mp -136.9 144.57 43.56 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.061 1.344 . . . . 0.0 108.368 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.404 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 32.2 mt-10 -93.04 145.87 24.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 160.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.71 129.81 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 176.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.58 137.63 49.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 104.03 -2.582 . . . . 0.0 104.03 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.82 134.78 55.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 119.249 0.931 . . . . 0.0 109.452 175.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.3 p -131.61 176.14 8.57 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.16 0.984 . . . . 0.0 110.391 -157.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -135.19 -178.11 4.95 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.645 1.578 . . . . 0.0 111.148 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -134.18 169.36 17.3 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.73 2.012 . . . . 0.0 108.706 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -139.59 162.62 34.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.146 1.378 . . . . 0.0 108.351 174.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.1 tp -143.77 40.3 1.4 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.504 1.122 . . . . 0.0 109.054 -176.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.9 p -62.23 -12.09 18.4 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -60.46 -24.75 65.49 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 120.475 -1.391 . . . . 0.0 111.999 167.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -76.27 -4.97 44.88 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.413 1.006 . . . . 0.0 112.451 173.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 tt -104.54 -50.09 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.579 1.551 . . . . 0.0 107.612 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.68 -32.73 69.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.979 1.312 . . . . 0.0 111.983 173.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.1 tptt 58.5 175.63 0.06 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.028 2.531 . . . . 0.0 113.702 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.04 163.05 28.38 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.851 0.86 . . . . 0.0 108.868 173.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.61 158.13 73.8 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.135 1.374 . . . . 0.0 108.164 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -84.98 29.97 0.53 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.5 3.467 . . . . 0.0 112.493 -171.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.632 1.973 . . . . 0.0 108.554 -171.761 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -140.05 85.85 2.05 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -150.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 mm -72.35 152.11 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 124.003 0.921 . . . . 0.0 109.357 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -141.98 151.8 42.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.716 1.607 . . . . 0.0 110.178 170.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -113.73 102.43 10.24 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.7 mm -69.04 -53.69 24.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -159.73 -166.6 1.79 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.888 1.675 . . . . 0.0 108.694 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.73 -16.38 60.97 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -126.19 -26.53 3.36 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.643 1.177 . . . . 0.0 112.725 -164.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 73.4 m -115.21 134.76 54.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.553 1.141 . . . . 0.0 108.241 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.6 m -122.44 157.57 27.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 166.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -134.76 168.09 19.66 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 162.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.462 ' CE1' HG21 ' A' ' 44' ' ' VAL . 41.0 p90 -149.77 162.51 40.13 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -117.45 126.76 53.18 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 171.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.8 ttt -115.98 108.26 16.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 125.37 1.468 . . . . 0.0 108.02 -177.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.18 147.89 51.63 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.736 171.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -51.35 -39.33 56.83 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.27 -25.17 71.03 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 118.729 -1.04 . . . . 0.0 113.237 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -70.93 -38.58 72.92 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.773 1.787 . . . . 0.0 110.822 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.1 mt -64.47 -47.27 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -58.93 -43.49 91.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.349 1.459 . . . . 0.0 111.858 174.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.68 -44.98 94.86 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.928 0.891 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -68.62 -5.29 19.17 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.018 0.927 . . . . 0.0 111.733 172.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.75 12.47 84.47 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 124.502 1.049 . . . . 0.0 112.87 175.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -78.58 -175.08 4.15 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 163.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.428 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.1 t70 -133.42 144.08 49.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.6 ptt180 -55.36 -33.51 63.47 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.785 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.06 -49.43 15.35 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.778 0.717 . . . . 0.0 109.411 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.428 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.5 mm-40 -59.76 -34.92 73.61 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.973 0.909 . . . . 0.0 112.146 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -49.94 -52.0 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 123.521 0.729 . . . . 0.0 109.566 171.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -65.73 -36.97 85.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.045 0.839 . . . . 0.0 111.243 -177.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -101.29 1.65 38.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -160.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -135.65 91.46 2.71 Favored 'General case' 0 CA--C 1.524 -0.056 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -59.59 -50.78 72.54 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -160.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -31.52 64.72 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 174.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -80.55 -18.51 48.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.52 175.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.96 -52.16 64.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 165.367 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -52.18 -34.09 43.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.359 1.463 . . . . 0.0 113.098 -168.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -57.52 -37.47 73.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.356 1.063 . . . . 0.0 111.646 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -56.25 24.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.761 0.824 . . . . 0.0 108.92 176.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -62.14 -35.1 77.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.732 0.813 . . . . 0.0 109.888 -176.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 63.9 m95 -65.09 -34.81 79.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.787 -1.101 . . . . 0.0 112.907 171.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -35.62 71.43 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 121.099 1.772 . . . . 0.0 111.277 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.7 m -75.02 -36.8 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 121.118 -0.989 . . . . 0.0 111.779 176.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -46.0 80.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 118.986 -0.53 . . . . 0.0 110.255 165.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.67 -34.94 73.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.697 0.681 . . . . 0.0 112.316 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.47 -17.08 11.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 112.578 173.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 30.5 m -134.78 11.67 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.592 1.557 . . . . 0.0 112.46 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -26.65 39.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.526 1.131 . . . . 0.0 113.129 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.63 -22.36 66.36 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -104.6 -39.83 6.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.668 1.187 . . . . 0.0 110.165 173.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -65.71 -21.23 66.51 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.258 -0.877 . . . . 0.0 112.177 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -58.38 -19.98 40.28 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.912 1.687 . . . . 0.0 112.384 171.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -99.7 6.22 45.61 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.415 1.486 . . . . 0.0 111.291 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.82 -4.86 1.05 Allowed 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -173.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -88.12 1.05 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 121.314 1.87 . . . . 0.0 112.397 169.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -57.35 -12.75 2.69 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.217 1.007 . . . . 0.0 112.783 149.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -130.1 -178.21 15.29 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.994 1.759 . . . . 0.0 110.695 176.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.02 177.46 7.73 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.526 2.818 . . . . 0.0 113.172 -166.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.0 tp -141.42 149.63 41.29 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.417 1.487 . . . . 0.0 107.009 166.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -145.1 151.22 38.15 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.255 1.422 . . . . 0.0 107.582 -171.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.6 mm -133.26 144.07 37.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -170.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -140.58 149.94 43.01 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.827 1.651 . . . . 0.0 107.135 163.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.6 155.92 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 120.755 -1.216 . . . . 0.0 110.143 -173.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.71 150.47 36.33 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 161.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.92 148.62 26.14 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 167.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mp -128.89 -177.06 4.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.354 2.662 . . . . 0.0 108.319 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.6 -32.52 73.55 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -169.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.448 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.1 mmtm -138.33 19.39 2.76 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.324 1.049 . . . . 0.0 112.663 -176.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 177.5 -164.98 34.46 Favored Glycine 0 C--O 1.225 -0.422 0 O-C-N 121.119 -0.988 . . . . 0.0 111.144 -175.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.5 mp -131.42 145.87 52.0 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.748 1.619 . . . . 0.0 107.264 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -103.19 130.83 50.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 160.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -118.38 128.09 75.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 105.032 -2.211 . . . . 0.0 105.032 178.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -104.41 144.51 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 168.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.87 127.64 40.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -176.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -131.74 170.59 14.6 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 118.902 0.774 . . . . 0.0 111.535 -163.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -131.31 165.04 24.31 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.991 1.317 . . . . 0.0 109.545 163.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.03 139.31 54.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.023 -175.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -145.85 161.9 38.93 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.305 1.842 . . . . 0.0 107.245 166.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -128.74 156.08 44.09 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.808 1.243 . . . . 0.0 108.221 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.3 m 50.92 36.89 16.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.387 1.475 . . . . 0.0 113.631 171.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -55.06 -47.48 74.79 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.561 -0.712 . . . . 0.0 111.062 -171.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -69.47 -4.69 19.79 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.454 1.101 . . . . 0.0 113.244 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.0 mt -125.97 -21.5 4.33 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.711 1.205 . . . . 0.0 111.593 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -132.46 -24.39 2.03 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.974 0.91 . . . . 0.0 112.639 -176.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -112.86 1.67 15.61 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.62 163.45 1.82 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.1 0.56 . . . . 0.0 110.933 162.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.7 m -137.15 158.11 73.17 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.791 1.237 . . . . 0.0 108.263 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -85.58 31.03 0.49 Allowed 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 124.454 3.436 . . . . 0.0 112.491 -173.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.582 1.953 . . . . 0.0 108.393 -172.615 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 ptm . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.61 72.84 1.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.035 1.334 . . . . 0.0 107.959 -166.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 mm -62.03 151.88 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 124.923 1.289 . . . . 0.0 109.468 175.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -147.67 127.24 13.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.855 1.262 . . . . 0.0 110.147 172.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -82.22 110.38 17.36 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.467 HD11 ' HG2' ' A' ' 12' ' ' LYS . 21.0 mm -74.53 -55.71 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -156.86 -165.19 1.79 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.406 1.483 . . . . 0.0 108.643 -177.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.68 -20.86 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.14 0.976 . . . . 0.0 113.474 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -124.67 -42.3 2.08 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.966 0.906 . . . . 0.0 111.613 -166.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 55.6 m -92.2 137.85 32.02 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 m -127.07 155.77 38.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 166.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.467 ' HG2' HD11 ' A' ' 6' ' ' ILE . 42.6 pttt -129.73 171.57 12.53 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 165.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -151.42 152.42 33.04 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -105.56 142.51 35.18 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 166.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.9 ttt -138.24 104.75 5.28 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 125.017 1.327 . . . . 0.0 108.063 -172.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -67.06 154.07 42.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -51.61 -33.35 32.6 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.23 -11.2 76.26 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 119.897 -1.144 . . . . 0.0 113.41 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -68.69 -40.54 80.03 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.702 1.751 . . . . 0.0 108.846 166.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.4 mt -64.12 -46.38 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.162 1.385 . . . . 0.0 108.698 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.71 -35.3 80.36 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.47 0.308 . . . . 0.0 111.346 -177.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.33 -43.38 98.95 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.362 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.1 mtt-85 -69.35 -7.08 34.15 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.355 1.062 . . . . 0.0 111.455 174.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.62 84.6 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.412 1.006 . . . . 0.0 112.731 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -83.89 -175.13 5.66 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -141.56 148.7 39.73 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -57.01 -36.64 70.66 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.142 0.883 . . . . 0.0 111.397 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -76.06 -45.06 36.1 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.05 -37.06 81.27 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.256 -0.902 . . . . 0.0 111.866 -173.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -54.71 -44.81 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 124.146 0.978 . . . . 0.0 110.126 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -69.79 -26.48 64.29 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -120.98 8.73 10.47 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -157.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -131.48 100.59 5.2 Favored 'General case' 0 N--CA 1.458 -0.057 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -58.18 -16.69 14.48 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -165.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.34 -31.09 6.69 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.53 1.532 . . . . 0.0 111.777 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -77.71 -18.0 57.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.232 0.924 . . . . 0.0 111.124 176.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.3 p -54.39 -55.18 31.24 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.932 0.893 . . . . 0.0 109.329 165.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -56.89 -31.3 64.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.376 1.87 . . . . 0.0 112.865 -169.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -58.94 -36.13 74.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.453 1.101 . . . . 0.0 111.109 -177.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -55.69 29.04 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -62.82 -36.1 82.09 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.095 0.958 . . . . 0.0 109.809 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -62.15 -38.81 90.4 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.765 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.66 -34.74 77.54 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.39 1.45 . . . . 0.0 110.698 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.8 m -77.59 -39.44 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 120.921 -1.112 . . . . 0.0 111.795 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -42.6 77.03 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.846 -0.533 . . . . 0.0 110.098 169.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.44 -40.18 85.96 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.051 0.541 . . . . 0.0 111.849 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -60.8 -11.23 7.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.903 1.281 . . . . 0.0 112.936 173.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -123.04 5.11 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.304 1.842 . . . . 0.0 109.571 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -57.14 -31.9 65.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.245 -1.534 . . . . 0.0 114.031 -166.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.15 -12.75 42.88 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -114.95 -37.28 4.2 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.765 1.626 . . . . 0.0 110.318 175.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -58.66 -29.32 66.49 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.491 -0.755 . . . . 0.0 110.948 174.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -59.18 -13.29 6.92 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.112 1.324 . . . . 0.0 113.863 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -124.86 14.85 8.6 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.665 1.186 . . . . 0.0 111.829 173.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -128.76 -4.16 5.23 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.696 1.198 . . . . 0.0 112.973 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.4 p -78.83 62.11 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 123.362 1.553 . . . . 0.0 110.858 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -159.48 32.37 0.2 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.8 1.24 . . . . 0.0 109.314 -168.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.48 -177.16 38.22 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.753 1.644 . . . . 0.0 109.795 -177.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.6 170.89 16.5 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.294 2.663 . . . . 0.0 111.377 -179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.39 148.41 46.18 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -138.24 148.52 44.83 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.6 mm -139.34 141.41 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -143.78 161.78 37.74 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.664 0.786 . . . . 0.0 109.461 156.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.4 p -152.23 157.76 4.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 O-C-N 121.203 -0.936 . . . . 0.0 109.868 -171.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -144.74 149.56 35.75 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 162.466 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.41 146.97 32.52 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 165.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.07 -179.18 4.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.103 2.561 . . . . 0.0 108.163 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -62.08 -31.06 71.46 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -166.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.3 mmtm -140.39 22.0 2.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.25 1.02 . . . . 0.0 112.197 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.92 -168.79 37.99 Favored Glycine 0 CA--C 1.519 0.323 0 O-C-N 121.059 -1.026 . . . . 0.0 111.275 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.0 mp -132.38 146.38 51.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 125.793 1.637 . . . . 0.0 107.703 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.81 131.29 52.47 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 160.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -116.15 135.07 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.819 -2.289 . . . . 0.0 104.819 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -111.82 141.96 25.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 165.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.92 144.06 37.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.49 161.71 34.28 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -161.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.3 mppt? -143.31 163.96 31.56 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.973 1.709 . . . . 0.0 108.027 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -137.78 28.56 2.65 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.521 1.128 . . . . 0.0 110.829 -170.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -93.06 14.2 18.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.696 0.798 . . . . 0.0 112.951 -168.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.0 tp -52.58 -37.18 57.5 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.678 0.791 . . . . 0.0 111.432 178.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.6 m -64.09 1.5 0.69 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.369 1.468 . . . . 0.0 114.183 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -53.3 -29.58 34.17 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.998 -1.064 . . . . 0.0 110.249 162.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -113.52 121.29 43.8 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 164.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.3 tp -160.29 142.68 13.11 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.3 t70 61.45 -21.89 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.826 2.451 . . . . 0.0 115.773 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -62.15 153.62 29.63 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 119.34 0.973 . . . . 0.0 111.016 176.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.65 161.09 24.09 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.624 0.77 . . . . 0.0 109.665 174.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -136.92 161.97 58.5 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 125.385 1.474 . . . . 0.0 108.645 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -53.06 156.13 10.39 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.822 3.015 . . . . 0.0 113.401 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.798 1.639 . . . . 0.0 107.748 178.94 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -143.08 128.01 18.39 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 -150.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.47 150.49 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 120.285 1.402 . . . . 0.0 108.675 -168.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.9 151.51 42.72 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.012 1.325 . . . . 0.0 110.032 174.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.91 103.58 11.08 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.8 mm -69.72 -55.14 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -157.18 -171.41 3.61 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.038 1.735 . . . . 0.0 108.058 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.07 -13.14 14.83 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.56 1.144 . . . . 0.0 113.593 -175.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -123.04 -52.25 1.87 Allowed 'General case' 0 C--N 1.342 0.252 0 O-C-N 121.048 -1.033 . . . . 0.0 110.851 -171.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.0 m -80.93 141.36 34.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -128.81 158.77 41.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.1 pttt -134.84 164.07 28.39 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 164.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -149.85 165.47 32.44 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -124.78 136.62 54.01 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 172.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.3 ttt -133.21 116.34 16.09 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.7 m -76.61 156.57 32.62 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.452 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.4 m-85 -55.5 -43.61 75.82 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.207 -0.933 . . . . 0.0 111.908 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.38 -9.85 86.59 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-O 118.587 -1.118 . . . . 0.0 113.451 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -66.02 -36.22 82.67 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.883 1.841 . . . . 0.0 109.062 166.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.94 -41.03 31.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.151 1.38 . . . . 0.0 107.672 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.88 -37.9 83.78 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.349 0.522 . . . . 0.0 111.502 174.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.67 -42.14 91.68 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.878 0.847 . . . . 0.0 110.895 -177.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.7 mtt85 -68.47 -8.99 45.82 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.382 172.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.95 12.98 83.87 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.457 1.027 . . . . 0.0 112.866 177.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.56 -170.74 3.26 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 165.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -142.37 150.92 41.34 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 172.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -60.94 -32.4 71.92 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -169.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -84.84 -42.65 14.89 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -57.86 -36.09 71.85 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 124.092 0.957 . . . . 0.0 112.419 -173.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.2 mm -44.15 -51.55 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.703 1.201 . . . . 0.0 110.586 169.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -78.43 -14.28 59.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.75 7.82 9.96 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -166.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -125.32 99.1 5.91 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.552 1.541 . . . . 0.0 106.958 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -54.82 -20.57 8.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.732 1.613 . . . . 0.0 115.068 -169.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.87 -30.62 9.26 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.963 0.801 . . . . 0.0 112.02 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -78.49 -16.7 57.24 Favored 'General case' 0 C--N 1.338 0.079 0 CA-C-N 118.92 0.782 . . . . 0.0 111.281 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 12.9 p -54.06 -58.56 6.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 166.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.39 -31.42 63.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.438 1.895 . . . . 0.0 112.486 -166.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 2.9 mm-40 -59.89 -35.22 74.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 111.307 -176.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -56.86 16.28 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 122.301 1.048 . . . . 0.0 108.548 175.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.25 -37.91 89.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.451 1.1 . . . . 0.0 110.395 -174.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -58.63 -37.0 74.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.969 172.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.52 -43.44 76.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.347 1.431 . . . . 0.0 110.388 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.8 m -71.13 -40.89 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.935 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.7 mmt -58.53 -43.28 89.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 122.802 0.441 . . . . 0.0 110.647 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -60.27 -42.09 94.64 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.584 0.629 . . . . 0.0 111.256 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -64.21 -6.0 5.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.37 1.868 . . . . 0.0 112.161 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -126.77 -0.89 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.635 1.974 . . . . 0.0 109.571 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -57.31 -28.83 63.41 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -161.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.13 -22.26 60.59 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.055 0.843 . . . . 0.0 112.415 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -100.43 -0.91 37.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.065 1.346 . . . . 0.0 111.616 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.12 -20.37 3.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.276 1.03 . . . . 0.0 111.801 -163.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -59.71 -14.48 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.942 1.297 . . . . 0.0 114.316 -174.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -126.01 18.31 7.82 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.522 1.529 . . . . 0.0 110.486 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.24 27.74 1.56 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.143 1.377 . . . . 0.0 112.061 -174.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.28 48.52 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 123.098 1.428 . . . . 0.0 107.716 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -122.35 35.48 4.87 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.469 2.308 . . . . 0.0 108.053 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.77 -177.24 37.2 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 126.418 1.961 . . . . 0.0 109.441 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -69.88 170.93 15.56 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.501 2.8 . . . . 0.0 111.943 -176.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.42 152.37 48.31 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 172.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -148.62 145.04 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.367 1.467 . . . . 0.0 107.185 -163.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.7 mm -135.33 145.41 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -133.21 148.51 52.03 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 158.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.3 p -136.22 157.77 37.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 171.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.25 151.57 37.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 159.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.01 143.54 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.402 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -125.78 -171.87 2.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.215 2.606 . . . . 0.0 107.691 -173.097 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.11 -37.96 84.61 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -166.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.452 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.3 mmtm -141.78 27.45 1.83 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.363 1.065 . . . . 0.0 112.379 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.74 -169.07 38.92 Favored Glycine 0 C--O 1.23 -0.139 0 O-C-N 120.929 -1.107 . . . . 0.0 110.478 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mp -135.26 144.35 46.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.222 1.009 . . . . 0.0 109.236 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.402 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.8 mt-10 -93.2 133.93 35.9 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.53 132.1 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -112.24 143.31 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 170.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.52 136.33 52.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 118.839 0.745 . . . . 0.0 109.365 171.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -129.69 174.98 9.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.182 0.993 . . . . 0.0 110.146 -160.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -135.19 -177.85 4.83 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.239 1.416 . . . . 0.0 110.721 172.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -134.71 163.51 29.61 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.522 1.929 . . . . 0.0 108.254 175.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -147.09 -41.46 0.18 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.107 0.563 . . . . 0.0 111.669 -177.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -149.39 142.15 24.61 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 m -68.13 56.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.351 2.26 . . . . 0.0 112.742 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -56.87 -43.15 80.95 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.467 -1.395 . . . . 0.0 110.691 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -77.75 35.63 0.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.318 1.447 . . . . 0.0 111.786 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.6 tt -154.85 -43.38 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.914 2.086 . . . . 0.0 107.6 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.36 -45.8 89.5 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.783 0.833 . . . . 0.0 110.848 168.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -69.62 152.09 45.16 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 168.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.73 149.56 46.44 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -141.27 161.88 50.62 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.613 1.565 . . . . 0.0 108.402 178.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.81 157.05 10.89 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.047 3.165 . . . . 0.0 113.212 174.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.968 1.707 . . . . 0.0 107.749 179.234 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptm . . . . . 0 N--CA 1.496 1.839 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -134.75 130.71 36.62 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.0 mm -122.31 152.24 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 125.057 1.343 . . . . 0.0 108.907 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.01 152.18 46.05 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.12 1.368 . . . . 0.0 110.121 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -119.59 92.61 3.83 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.038 1.735 . . . . 0.0 106.461 177.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.9 -53.51 40.8 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -157.28 -162.98 1.29 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.006 1.722 . . . . 0.0 108.24 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -67.48 -17.12 64.57 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -123.81 -50.26 1.84 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.411 -0.805 . . . . 0.0 110.852 -164.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 27.8 m -81.42 133.07 35.36 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 170.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -128.94 159.9 40.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 163.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.4 pttt -139.13 167.14 22.73 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 164.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 44' ' ' VAL . 53.8 p90 -148.95 166.69 27.86 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -125.38 133.99 52.33 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 106.128 -1.805 . . . . 0.0 106.128 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.4 tpt -129.42 107.23 9.34 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -169.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.67 154.62 41.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.9 m-85 -53.52 -37.91 63.26 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.707 -0.621 . . . . 0.0 111.893 175.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.54 -26.08 74.85 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.304 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.81 -30.66 69.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.692 1.746 . . . . 0.0 110.316 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.97 -44.62 28.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -58.9 -39.82 82.62 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 124.835 1.254 . . . . 0.0 111.631 175.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.98 -44.16 97.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.96 0.886 . . . . 0.0 111.257 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 79.3 mtt85 -72.09 -5.6 36.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.677 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 11.64 85.02 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.719 1.152 . . . . 0.0 112.903 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -85.05 -175.09 5.61 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 168.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -135.33 146.54 48.54 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 173.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -52.86 -35.28 57.4 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.991 0.814 . . . . 0.0 111.119 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -80.39 -45.11 18.25 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.537 1.135 . . . . 0.0 108.967 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -61.18 -36.09 78.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.213 1.005 . . . . 0.0 112.319 -176.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.88 -49.87 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -84.21 -26.4 28.76 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -97.39 -17.08 19.92 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.937 0.495 . . . . 0.0 111.316 -167.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.8 -171.48 3.54 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 158.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -135.98 -48.01 0.67 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.186 -0.946 . . . . 0.0 111.136 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -34.64 76.54 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.369 0.668 . . . . 0.0 110.605 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -79.84 -12.54 59.75 Favored 'General case' 0 C--N 1.34 0.182 0 O-C-N 121.49 -0.756 . . . . 0.0 111.925 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.71 -41.5 75.26 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 168.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.603 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 15.7 tt0 -56.28 -30.98 63.19 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.128 1.371 . . . . 0.0 113.013 -171.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.76 -33.5 75.79 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.653 1.981 . . . . 0.0 111.033 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -44.88 92.24 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.603 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -71.12 -40.68 71.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.652 0.781 . . . . 0.0 108.958 -173.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -56.45 -40.44 74.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.369 171.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.05 -22.26 65.6 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.396 0.998 . . . . 0.0 113.08 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -103.99 -38.09 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 119.846 1.203 . . . . 0.0 111.853 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -43.27 64.68 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 163.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.86 -44.64 66.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 123.779 0.832 . . . . 0.0 112.441 173.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -62.62 -7.37 4.64 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 t -129.02 -2.95 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 126.059 1.744 . . . . 0.0 110.003 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -59.99 -29.88 68.75 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.515 -1.365 . . . . 0.0 114.517 -159.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.84 -11.69 40.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.413 0.685 . . . . 0.0 112.46 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -113.82 -31.73 6.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.229 1.812 . . . . 0.0 110.623 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.26 -28.27 67.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.415 1.007 . . . . 0.0 111.009 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.28 -22.31 40.7 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.139 0.881 . . . . 0.0 112.747 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -83.75 -10.65 57.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.904 0.775 . . . . 0.0 112.335 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -138.15 4.83 2.5 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.294 1.038 . . . . 0.0 113.581 -165.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.59 77.6 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-O 122.801 1.286 . . . . 0.0 109.033 174.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -147.82 22.88 1.11 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.918 1.287 . . . . 0.0 110.827 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.25 176.89 42.59 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.796 1.189 . . . . 0.0 110.435 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.74 164.69 33.12 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.798 2.999 . . . . 0.0 112.03 -174.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.1 mt -87.53 158.93 18.8 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 164.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -143.18 141.75 31.23 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.57 143.17 39.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.386 0.994 . . . . 0.0 108.727 -172.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -137.38 155.66 49.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.147 1.379 . . . . 0.0 107.718 165.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.91 160.21 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 O-C-N 120.744 -1.222 . . . . 0.0 110.178 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.505 HE22 HD11 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -141.05 152.15 44.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 157.215 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.0 143.59 30.95 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.131 0.573 . . . . 0.0 109.618 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -125.93 -175.6 3.4 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.255 2.622 . . . . 0.0 107.599 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.9 -35.54 80.38 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -164.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.6 mmtm -141.07 25.54 2.09 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 112.14 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.91 -173.45 42.49 Favored Glycine 0 C--O 1.228 -0.27 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -175.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.52 144.86 46.54 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.478 1.111 . . . . 0.0 108.82 177.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -94.54 129.49 41.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 161.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.95 127.24 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.505 HD11 HE22 ' A' ' 65' ' ' GLN . 4.3 mp -95.8 147.09 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 166.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.97 139.99 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 172.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -134.94 168.47 19.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.097 0.959 . . . . 0.0 108.622 -173.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 mppt? . . . . . 0 N--CA 1.472 0.645 0 C-N-CA 124.505 1.122 . . . . 0.0 109.903 -178.47 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.737 0.303 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -124.98 77.95 1.66 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -160.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 mm -68.43 150.45 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.763 1.225 . . . . 0.0 109.327 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -151.66 102.25 2.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.355 1.062 . . . . 0.0 110.226 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -72.78 118.38 15.65 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.267 -1.521 . . . . 0.0 106.907 171.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 32.9 mm -81.92 -53.54 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -163.62 -175.14 4.01 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.894 1.677 . . . . 0.0 108.873 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.08 -14.99 1.81 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.366 1.467 . . . . 0.0 114.931 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -119.19 -27.26 5.71 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.265 1.426 . . . . 0.0 112.802 -167.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -129.81 140.79 50.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.457 1.103 . . . . 0.0 109.27 -172.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.8 m -130.07 153.64 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 106.219 -1.771 . . . . 0.0 106.219 166.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -132.29 168.31 18.31 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 168.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.521 ' CE1' HG21 ' A' ' 44' ' ' VAL . 40.8 p90 -155.0 165.17 37.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -118.69 140.91 49.17 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -132.38 112.13 11.91 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.9 m -73.19 156.97 38.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.1 m-85 -52.06 -43.44 63.81 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 121.985 -0.447 . . . . 0.0 111.745 173.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -78.81 -12.07 84.57 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 119.707 -1.235 . . . . 0.0 113.817 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -34.39 75.54 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.688 1.744 . . . . 0.0 109.422 165.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.15 -42.11 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -61.33 -37.54 83.65 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.735 0.698 . . . . 0.0 111.515 175.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.47 -42.51 98.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.838 0.828 . . . . 0.0 110.898 -176.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -72.39 -4.83 32.44 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.564 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.62 11.19 85.52 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.479 1.038 . . . . 0.0 113.071 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -82.86 -173.13 4.5 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 168.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -138.53 147.05 42.67 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 174.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.6 ptt85 -56.93 -35.5 69.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.676 0.671 . . . . 0.0 111.597 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.62 -45.52 29.8 Favored 'General case' 0 C--O 1.226 -0.147 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.97 -37.02 78.39 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 121.429 -0.795 . . . . 0.0 111.838 -172.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -53.32 -47.43 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.58 0.752 . . . . 0.0 109.947 171.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 m95 -68.64 -21.71 64.45 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.266 0.939 . . . . 0.0 112.943 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -120.56 4.06 10.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -161.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -137.87 83.56 1.99 Allowed 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -47.43 -42.77 23.06 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.58 -32.09 63.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.479 -0.763 . . . . 0.0 111.288 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -77.82 -19.66 54.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.95 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -51.96 64.89 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 166.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -52.42 -34.37 48.1 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.229 1.412 . . . . 0.0 113.228 -169.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.4 -36.56 69.06 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.797 1.239 . . . . 0.0 111.646 -179.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -53.06 62.63 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.093 0.957 . . . . 0.0 109.069 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -66.36 -32.42 73.8 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.398 1.079 . . . . 0.0 110.66 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -65.26 -44.43 88.12 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.889 170.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.94 -41.56 95.41 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.079 1.309 . . . . 0.0 110.878 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.521 HG21 ' CE1' ' A' ' 13' ' ' PHE . 27.9 m -68.96 -44.01 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 O-C-N 121.251 -0.906 . . . . 0.0 112.147 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 43.9 tpp -59.35 -39.56 83.63 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.03 -38.33 88.29 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.529 -0.732 . . . . 0.0 111.894 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.16 -13.8 41.38 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.52 1.528 . . . . 0.0 113.221 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 33.6 m -123.33 -5.34 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.361 1.064 . . . . 0.0 111.939 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -18.15 12.08 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -66.1 -16.9 64.34 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 120.277 1.399 . . . . 0.0 112.437 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -113.63 -36.88 4.76 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.483 0.713 . . . . 0.0 110.87 162.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -68.1 -13.07 61.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 118.003 -0.999 . . . . 0.0 112.473 -175.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -57.13 -27.41 61.82 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.486 1.494 . . . . 0.0 112.029 168.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -79.42 -5.87 55.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.285 0.634 . . . . 0.0 111.998 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.02 36.96 1.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.641 1.176 . . . . 0.0 111.205 -166.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.8 p -117.47 66.04 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 123.628 1.68 . . . . 0.0 106.577 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -153.18 36.41 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 113.942 -1.481 . . . . 0.0 109.251 -168.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.45 -176.25 39.21 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 126.087 1.803 . . . . 0.0 109.753 -173.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.45 170.07 12.95 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.459 2.773 . . . . 0.0 110.905 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.46 HD23 ' H ' ' A' ' 61' ' ' TRP . 0.5 OUTLIER -137.36 147.57 45.61 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.331 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.46 ' H ' HD23 ' A' ' 60' ' ' LEU . 90.4 m95 -143.74 144.19 31.72 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.557 1.543 . . . . 0.0 107.281 -164.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.454 HG23 HG12 ' A' ' 75' ' ' VAL . 3.8 mm -137.19 138.1 45.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -170.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -136.28 147.66 47.6 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.441 1.896 . . . . 0.0 107.641 169.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.37 154.74 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 O-C-N 120.975 -1.078 . . . . 0.0 109.671 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -144.85 150.22 36.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 161.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.68 146.94 26.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 169.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.67 179.81 5.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.976 2.51 . . . . 0.0 108.315 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -58.39 -36.48 73.62 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -168.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.506 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 34.0 mmtp -139.16 27.14 2.37 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.119 0.967 . . . . 0.0 112.329 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.08 -168.32 37.38 Favored Glycine 0 CA--C 1.521 0.409 0 O-C-N 121.005 -1.059 . . . . 0.0 111.692 -174.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -133.0 145.19 50.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.112 1.765 . . . . 0.0 107.516 176.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -103.09 136.52 42.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 159.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.443 HD13 ' CE2' ' A' ' 13' ' ' PHE . 1.0 OUTLIER -123.58 131.38 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 178.767 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -111.84 136.51 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 168.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.454 HG12 HG23 ' A' ' 62' ' ' ILE . 4.2 m -131.08 141.94 44.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 119.569 1.077 . . . . 0.0 108.696 172.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.2 p -134.38 162.91 30.89 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -161.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.338 0 C-N-CA 126.28 1.832 . . . . 0.0 107.492 174.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ptm . . . . . 0 N--CA 1.495 1.805 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.81 76.93 1.24 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.155 1.382 . . . . 0.0 107.794 -161.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -66.83 153.01 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 124.523 1.129 . . . . 0.0 109.599 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -146.76 138.17 24.3 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.972 1.309 . . . . 0.0 109.413 168.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mmt85 -89.85 126.45 35.71 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.98 -1.075 . . . . 0.0 108.142 166.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.453 HD11 ' HG2' ' A' ' 12' ' ' LYS . 24.1 mm -83.01 -61.94 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 172.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -153.55 17.7 0.53 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 111.526 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 74.16 -34.63 0.28 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 128.074 2.549 . . . . 0.0 113.603 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -68.56 -38.48 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.428 1.013 . . . . 0.0 108.859 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.1 m -110.12 140.4 44.24 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.642 1.577 . . . . 0.0 107.484 168.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 m -129.1 162.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 166.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HG2' HD11 ' A' ' 6' ' ' ILE . 49.9 pttt -135.39 172.74 12.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.763 -1.211 . . . . 0.0 109.683 165.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -144.8 160.55 41.08 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 168.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -118.27 149.5 41.02 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 162.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 4.8 ttt -144.64 103.41 3.93 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 -168.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.8 m -67.48 153.19 44.27 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.9 m-85 -53.12 -31.63 43.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.81 -25.51 73.06 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-O 119.066 -0.852 . . . . 0.0 113.663 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.86 -37.0 75.98 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.757 1.779 . . . . 0.0 109.739 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 11.3 mt -68.49 -44.71 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.405 1.482 . . . . 0.0 109.178 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -58.46 -38.92 78.55 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.587 1.155 . . . . 0.0 111.439 174.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.66 -40.7 97.86 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.518 0.675 . . . . 0.0 111.69 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtt-85 -68.51 -11.84 60.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.016 1.327 . . . . 0.0 111.27 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.51 3.19 78.36 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.61 1.576 . . . . 0.0 112.179 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.404 ' CE2' ' HG2' ' A' ' 39' ' ' GLU . 24.7 m-85 -90.19 -178.41 5.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.788 1.235 . . . . 0.0 110.081 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -137.89 153.33 49.55 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -60.65 -31.92 71.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.467 -170.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -81.79 -46.26 14.44 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -56.83 -35.73 69.16 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.0 0.92 . . . . 0.0 112.751 -171.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.1 mm -44.39 -53.49 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.604 1.162 . . . . 0.0 109.339 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 50.1 m95 -75.01 -17.07 60.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -115.33 8.95 15.53 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.328 0.651 . . . . 0.0 112.334 -165.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -142.03 92.42 2.44 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -50.86 -46.97 60.51 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.556 1.071 . . . . 0.0 112.655 -166.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.01 -21.52 65.94 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.565 -0.71 . . . . 0.0 111.515 -176.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -98.67 -5.63 31.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.062 1.345 . . . . 0.0 111.632 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.92 -49.85 14.63 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -55.78 -32.74 63.74 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.538 1.135 . . . . 0.0 112.921 -170.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.404 ' HG2' ' CE2' ' A' ' 25' ' ' PHE . 3.1 pp20? -53.15 -37.13 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.798 0.839 . . . . 0.0 111.848 174.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -59.07 6.0 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.412 ' HA ' HG22 ' A' ' 44' ' ' VAL . 76.9 m-85 -64.24 -40.02 95.16 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.073 1.349 . . . . 0.0 110.335 -173.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -61.13 -36.92 81.03 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 117.729 -1.129 . . . . 0.0 112.434 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -72.42 -37.18 68.7 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.669 1.577 . . . . 0.0 111.549 178.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 41' ' ' PHE . 17.6 m -70.47 -41.45 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 120.006 1.276 . . . . 0.0 111.152 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -42.08 87.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.934 -0.479 . . . . 0.0 110.445 170.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -58.06 -40.89 82.11 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 122.757 0.423 . . . . 0.0 111.269 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.57 -5.25 2.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.927 1.691 . . . . 0.0 112.78 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.5 t -131.94 2.76 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 126.404 1.881 . . . . 0.0 109.895 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -55.76 -37.47 68.57 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.162 -1.587 . . . . 0.0 113.985 -162.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.38 -8.76 27.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -119.06 -36.13 3.47 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.787 2.035 . . . . 0.0 109.901 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -57.17 -31.85 65.82 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.931 0.892 . . . . 0.0 110.984 170.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -57.39 -21.98 39.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.68 1.127 . . . . 0.0 112.854 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -83.97 -14.23 51.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.893 0.77 . . . . 0.0 112.381 176.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.95 -0.42 3.1 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -165.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.57 69.27 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 122.994 1.378 . . . . 0.0 110.404 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -155.73 27.73 0.38 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.062 1.345 . . . . 0.0 110.195 -173.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.44 -178.82 38.82 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.021 1.296 . . . . 0.0 110.557 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.9 169.49 18.97 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.762 2.975 . . . . 0.0 111.962 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.4 tp -129.72 148.15 51.57 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.48 1.512 . . . . 0.0 107.12 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -140.02 146.87 39.58 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -170.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -135.52 142.76 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -140.13 91.21 2.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.95 1.3 . . . . 0.0 108.196 165.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.82 154.59 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.521 0.728 . . . . 0.0 109.078 166.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.0 152.05 32.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 152.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.57 143.29 32.93 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 123.612 0.765 . . . . 0.0 109.883 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.475 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.7 mp -129.46 -176.03 3.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.968 2.507 . . . . 0.0 108.306 -172.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.04 -34.77 76.87 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -140.42 21.69 2.38 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.303 1.041 . . . . 0.0 112.355 -177.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.9 -170.15 40.48 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mp -134.74 142.62 46.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.863 1.265 . . . . 0.0 109.262 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.475 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 20.8 mt-10 -94.57 143.5 26.37 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 162.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.93 123.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.4 mp -92.42 145.64 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 104.675 -2.343 . . . . 0.0 104.675 167.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.65 131.73 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.84 159.41 39.89 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -165.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 mppt? . . . . . 0 C--O 1.234 0.244 0 C-N-CA 126.97 2.108 . . . . 0.0 108.39 174.831 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.797 0.332 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -127.4 78.09 1.79 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -151.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 mp -76.8 153.71 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.494 1.118 . . . . 0.0 109.772 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -134.69 156.14 49.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.312 2.245 . . . . 0.0 108.154 170.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -124.29 89.34 3.06 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 176.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.0 -52.83 56.55 Favored 'Isoleucine or valine' 0 C--N 1.345 0.399 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -157.14 -164.1 1.53 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.189 1.796 . . . . 0.0 107.206 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -72.49 -9.93 59.17 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -176.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -126.6 -40.63 1.91 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.042 -1.036 . . . . 0.0 112.184 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.8 m -92.86 134.53 34.99 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 165.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 m -128.88 156.55 41.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 165.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -142.13 169.66 17.18 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 121.018 -1.052 . . . . 0.0 108.558 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.559 ' CD1' HG21 ' A' ' 44' ' ' VAL . 38.1 p90 -153.52 163.62 39.65 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 172.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -115.31 143.12 45.74 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -136.85 108.24 6.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.81 1.244 . . . . 0.0 107.872 -175.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -68.1 153.94 42.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-30 -52.2 -38.7 58.66 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 122.851 0.461 . . . . 0.0 112.121 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.79 -25.52 70.58 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 119.24 -0.755 . . . . 0.0 113.385 -177.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -69.31 -38.71 78.38 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.995 1.397 . . . . 0.0 109.979 175.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.54 -43.56 71.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 125.452 1.501 . . . . 0.0 108.345 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.92 -40.84 85.75 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.03 1.332 . . . . 0.0 111.581 175.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -62.85 -42.06 99.6 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.566 0.698 . . . . 0.0 111.237 -177.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -68.46 -13.19 62.14 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.916 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.1 13.32 83.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.734 1.159 . . . . 0.0 112.953 -176.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -82.86 -173.74 4.85 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.431 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.4 t70 -141.89 147.49 37.21 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -53.72 -35.77 61.54 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.834 0.743 . . . . 0.0 111.443 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.78 -42.1 25.15 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.313 0.506 . . . . 0.0 109.863 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.431 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.92 -37.71 85.68 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.05 -1.031 . . . . 0.0 111.058 -175.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.63 -43.87 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.797 1.239 . . . . 0.0 110.254 170.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.59 -28.35 66.86 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.121 0.873 . . . . 0.0 113.057 177.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -120.92 8.79 10.51 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -155.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -132.18 98.17 4.34 Favored 'General case' 0 C--N 1.335 -0.053 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.2 ttp85 -54.27 -23.45 15.04 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.245 1.418 . . . . 0.0 114.74 -169.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 -31.16 10.69 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 118.902 0.774 . . . . 0.0 111.864 178.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -79.83 -17.47 53.2 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.068 0.849 . . . . 0.0 111.316 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 p -59.35 -53.3 59.81 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 167.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -30.94 63.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.316 1.846 . . . . 0.0 113.25 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.411 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.6 mm-40 -58.54 -34.29 70.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.53 1.132 . . . . 0.0 111.165 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -52.71 64.54 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 122.501 1.143 . . . . 0.0 109.023 175.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -67.82 -33.3 74.52 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.806 0.843 . . . . 0.0 109.851 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -63.23 -29.9 71.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.578 172.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -76.52 -45.11 32.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.289 1.404 . . . . 0.0 108.843 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.559 HG21 ' CD1' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -61.94 -49.33 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.631 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 36.8 tpp -63.81 -34.8 78.72 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.54 -177.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.04 -41.03 82.4 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 119.061 0.846 . . . . 0.0 111.212 174.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -35.78 78.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.768 0.427 . . . . 0.0 111.178 175.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.99 -13.06 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.088 178.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 52' ' ' GLU . 3.4 t-80 -60.01 -30.41 69.13 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -152.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -62.25 -21.09 64.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.12 0.873 . . . . 0.0 112.268 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -96.46 -1.66 46.94 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.629 1.572 . . . . 0.0 110.924 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 49' ' ' HIS . 46.1 mm-40 -135.61 -15.74 1.83 Allowed 'General case' 0 C--N 1.338 0.092 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -158.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.58 -10.22 4.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.298 1.039 . . . . 0.0 113.293 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -117.46 13.76 14.49 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.88 2.072 . . . . 0.0 111.365 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.59 -22.99 1.65 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.924 1.29 . . . . 0.0 113.074 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -70.81 -4.29 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 120.638 1.563 . . . . 0.0 113.728 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -55.23 -20.62 11.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.517 1.527 . . . . 0.0 114.021 159.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -93.32 -173.39 40.24 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.637 1.113 . . . . 0.0 112.661 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -68.55 173.18 10.23 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.584 2.856 . . . . 0.0 111.08 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.1 mt -146.22 149.96 34.91 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.636 1.175 . . . . 0.0 108.431 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -147.7 148.01 30.56 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.165 1.386 . . . . 0.0 108.012 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 2.4 mm -135.51 149.4 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -138.82 143.5 38.9 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 161.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.4 p -147.76 157.06 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 O-C-N 120.405 -1.435 . . . . 0.0 109.876 -168.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -149.78 150.98 32.83 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 167.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.66 145.27 29.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 164.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -126.23 -179.8 4.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.779 2.432 . . . . 0.0 107.858 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.08 -32.26 71.91 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -166.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.505 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.0 mmtm -140.64 23.08 2.31 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.214 1.005 . . . . 0.0 112.227 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.16 -170.24 38.62 Favored Glycine 0 C--N 1.332 0.325 0 O-C-N 120.917 -1.114 . . . . 0.0 110.895 -173.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.6 mp -131.06 148.15 52.71 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.744 1.617 . . . . 0.0 107.297 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -105.38 136.12 45.5 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 158.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -127.05 120.36 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 105.007 -2.22 . . . . 0.0 105.007 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -102.61 143.65 14.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 104.634 -2.358 . . . . 0.0 104.634 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.15 141.05 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 172.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -135.92 164.2 28.51 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.361 0.664 . . . . 0.0 109.676 -165.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.288 0 C-N-CA 125.655 1.582 . . . . 0.0 108.158 172.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptm . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -127.55 79.61 1.9 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -152.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 mm -75.06 152.07 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 124.732 1.213 . . . . 0.0 109.804 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -141.95 148.35 38.49 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.579 1.952 . . . . 0.0 108.508 167.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.37 102.53 9.01 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.2 mm -70.93 -56.03 12.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 -170.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -162.61 -171.37 2.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.792 1.637 . . . . 0.0 108.84 -177.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.28 -6.12 8.91 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -118.91 -31.06 4.88 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.937 1.295 . . . . 0.0 111.601 -169.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.0 m -129.5 140.18 51.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.465 1.106 . . . . 0.0 109.278 -170.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.69 155.53 41.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 166.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -136.85 167.79 20.8 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.425 ' CE1' HG21 ' A' ' 44' ' ' VAL . 34.1 p90 -155.49 164.13 39.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.608 0.718 . . . . 0.0 109.351 172.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -114.93 142.61 46.36 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -136.43 115.53 12.42 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -72.77 158.66 35.15 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -53.61 -42.19 67.44 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 121.784 -0.573 . . . . 0.0 111.423 171.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.84 -27.05 69.51 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.167 -0.796 . . . . 0.0 113.043 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.92 -31.48 69.28 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.446 1.623 . . . . 0.0 110.778 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.8 mt -79.0 -43.97 24.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.837 1.255 . . . . 0.0 107.796 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -58.68 -40.71 84.36 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.289 1.436 . . . . 0.0 111.861 173.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.37 -44.62 95.44 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.165 0.986 . . . . 0.0 111.47 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -69.52 -6.88 33.63 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.578 173.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 12.91 84.16 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.465 1.031 . . . . 0.0 113.07 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -82.28 -174.28 5.04 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.419 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 7.7 t70 -137.35 144.65 42.64 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -55.63 -35.49 65.97 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.249 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -76.74 -44.49 33.01 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 118.708 0.686 . . . . 0.0 109.611 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.419 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.02 -37.7 83.49 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 121.389 -0.819 . . . . 0.0 111.311 -173.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -54.2 -45.82 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.78 0.832 . . . . 0.0 109.909 171.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -68.37 -22.2 64.67 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.452 1.024 . . . . 0.0 113.14 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -121.9 3.81 9.97 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -160.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -137.75 82.22 1.91 Allowed 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -178.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -46.28 -43.36 15.65 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.191 0.996 . . . . 0.0 113.654 -166.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.23 -32.21 64.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.684 -0.635 . . . . 0.0 111.683 -177.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -77.78 -20.39 53.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.647 -0.692 . . . . 0.0 110.968 174.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -52.72 62.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 166.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -52.59 -34.1 49.25 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.681 1.592 . . . . 0.0 113.311 -168.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -55.74 -36.32 67.13 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.979 1.311 . . . . 0.0 111.51 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -57.69 11.94 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.437 1.095 . . . . 0.0 108.829 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -62.6 -35.5 79.73 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.962 1.305 . . . . 0.0 110.033 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -62.87 -39.37 94.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.114 171.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -68.35 -41.88 80.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.31 1.414 . . . . 0.0 110.232 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.425 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -68.72 -42.25 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 121.331 -0.856 . . . . 0.0 111.458 -178.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.9 mmt -54.5 -48.58 71.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.177 0.591 . . . . 0.0 109.674 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.74 -41.32 90.71 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 122.521 0.329 . . . . 0.0 111.498 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -65.53 -12.54 53.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.195 1.798 . . . . 0.0 112.488 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.64 1.16 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.266 1.026 . . . . 0.0 111.778 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.55 -20.82 65.05 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -163.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.04 -20.84 60.01 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.403 1.001 . . . . 0.0 112.13 173.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -103.72 5.96 36.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.138 1.375 . . . . 0.0 111.144 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.16 -20.95 4.74 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.806 1.243 . . . . 0.0 111.93 -173.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.51 -18.58 59.73 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.277 1.031 . . . . 0.0 113.768 -173.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -102.88 3.57 36.7 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.272 1.429 . . . . 0.0 111.761 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.71 40.91 1.3 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.123 1.769 . . . . 0.0 109.869 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.94 66.61 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -153.89 37.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 113.513 -1.676 . . . . 0.0 108.86 -168.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.9 -175.31 35.53 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 126.099 1.809 . . . . 0.0 109.906 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.44 172.27 12.63 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.5 2.8 . . . . 0.0 111.465 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 35.6 mt -135.65 154.18 51.39 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.219 1.408 . . . . 0.0 107.955 171.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.9 m95 -149.2 145.7 27.26 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 125.245 1.418 . . . . 0.0 107.519 -164.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -134.82 143.71 36.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -175.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -137.6 147.44 45.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.083 1.753 . . . . 0.0 106.67 165.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.1 p -150.39 155.66 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 120.647 -1.283 . . . . 0.0 109.719 -170.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -148.95 150.63 33.2 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 164.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.19 146.16 26.12 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 167.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.32 -177.49 4.09 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.779 2.432 . . . . 0.0 108.045 177.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.51 -33.8 73.16 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -139.6 23.6 2.48 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.464 1.106 . . . . 0.0 112.607 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -179.53 -165.26 33.34 Favored Glycine 0 CA--C 1.521 0.444 0 O-C-N 121.11 -0.994 . . . . 0.0 111.624 -173.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 mp -132.48 148.55 52.4 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.939 1.696 . . . . 0.0 108.041 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -103.33 138.62 39.84 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 156.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.414 HD13 ' CE2' ' A' ' 13' ' ' PHE . 1.1 mp -127.2 129.14 70.89 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.026 0 N-CA-C 104.92 -2.252 . . . . 0.0 104.92 -178.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -112.17 141.98 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 170.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.0 m -135.9 138.39 47.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 121.243 -0.911 . . . . 0.0 108.549 171.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -133.75 166.87 21.63 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.169 0.588 . . . . 0.0 110.726 -160.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt . . . . . 0 C--O 1.234 0.274 0 C-N-CA 126.164 1.786 . . . . 0.0 110.241 167.625 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -146.03 136.95 24.46 Favored 'General case' 0 C--O 1.224 -0.274 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 -164.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.05 150.73 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 120.589 1.54 . . . . 0.0 107.95 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.88 151.91 41.56 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.699 1.2 . . . . 0.0 111.013 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 tpp85 -117.68 87.15 2.65 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.651 1.98 . . . . 0.0 106.105 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -57.1 -53.38 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.78 0.8 . . . . 0.0 109.166 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -152.85 -165.93 2.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.009 2.124 . . . . 0.0 106.32 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -78.25 0.41 25.35 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -128.97 -47.74 1.23 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.042 0.937 . . . . 0.0 111.931 -172.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 60.5 m -81.99 135.55 35.35 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 170.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.05 157.69 41.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 165.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -136.31 167.54 21.12 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 168.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CE1' HG21 ' A' ' 44' ' ' VAL . 48.7 p90 -149.2 165.35 32.13 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 175.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -127.53 128.74 46.17 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 3.7 ttt -123.78 117.0 23.91 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.928 1.291 . . . . 0.0 108.28 -170.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.6 m -78.09 153.54 32.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.4 m-85 -58.36 -36.45 73.49 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.329 -0.857 . . . . 0.0 112.171 176.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.94 -29.8 75.76 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-O 119.456 -0.636 . . . . 0.0 112.238 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.47 -37.28 74.25 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.86 1.33 . . . . 0.0 110.474 177.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 33.0 mt -67.1 -48.84 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.803 1.241 . . . . 0.0 109.266 178.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -58.65 -38.98 79.29 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 125.467 1.507 . . . . 0.0 110.954 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.99 -41.12 91.51 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.989 0.899 . . . . 0.0 110.629 -175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.1 mtt85 -67.76 -9.19 41.85 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.174 1.39 . . . . 0.0 111.865 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.3 11.13 82.66 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.692 1.139 . . . . 0.0 113.014 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -86.38 -174.64 5.13 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 166.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -141.33 153.64 45.24 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.112 -0.992 . . . . 0.0 108.344 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -64.73 -28.5 69.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -167.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -87.19 -44.68 11.3 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -57.32 -35.77 70.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 112.95 -171.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.23 -55.8 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.895 1.278 . . . . 0.0 109.344 168.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -76.63 -14.16 60.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -119.87 6.52 10.9 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.899 0.88 . . . . 0.0 112.517 -167.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -129.0 86.22 2.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 170.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -52.27 -35.1 49.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -163.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -31.83 40.58 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.09 0.556 . . . . 0.0 111.672 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -79.94 -16.32 55.51 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.175 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.16 -50.58 72.6 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 167.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -54.62 -31.99 58.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -168.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.3 mm-40 -59.19 -36.23 74.98 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.016 1.326 . . . . 0.0 111.228 -177.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -57.84 10.94 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.32 1.048 . . . . 0.0 108.701 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -63.03 -34.19 77.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.153 0.981 . . . . 0.0 110.454 -173.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -62.88 -35.89 81.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.503 -0.76 . . . . 0.0 112.516 173.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.98 -43.71 70.91 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 120.091 1.314 . . . . 0.0 110.522 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.445 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.98 -37.99 70.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 O-C-N 121.163 -0.96 . . . . 0.0 111.526 -178.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 19.5 tpp -62.74 -39.72 94.99 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.064 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -57.84 -38.61 75.96 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 120.171 1.35 . . . . 0.0 111.561 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.92 -9.96 2.18 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.658 1.583 . . . . 0.0 113.541 173.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.2 t -129.27 -9.25 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 126.3 1.84 . . . . 0.0 110.54 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.03 -28.25 69.96 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.843 -1.161 . . . . 0.0 113.984 -157.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -60.7 -16.09 35.77 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.745 0.702 . . . . 0.0 112.396 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -114.14 6.79 16.44 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.167 1.787 . . . . 0.0 110.803 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -132.73 -18.33 2.43 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.886 1.274 . . . . 0.0 112.557 -172.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.9 -23.17 60.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.567 1.076 . . . . 0.0 112.993 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -98.75 5.6 47.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.8 1.64 . . . . 0.0 111.82 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.17 -15.72 2.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.067 1.347 . . . . 0.0 112.927 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.75 3.04 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 120.282 1.401 . . . . 0.0 113.697 173.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -57.16 -19.7 21.96 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.241 1.017 . . . . 0.0 113.077 155.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -107.97 -177.84 22.18 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.233 1.397 . . . . 0.0 111.762 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.02 170.16 19.6 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.614 2.876 . . . . 0.0 112.803 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.6 tp -144.32 153.76 42.33 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.121 1.768 . . . . 0.0 106.499 169.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -142.0 151.6 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.679 1.592 . . . . 0.0 107.05 -173.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.449 HG23 HG12 ' A' ' 75' ' ' VAL . 4.3 mm -139.27 139.22 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -170.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.22 167.53 22.2 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.793 1.237 . . . . 0.0 109.439 161.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.1 p -144.23 160.16 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.503 0.721 . . . . 0.0 109.864 -169.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -131.31 146.23 52.21 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 127.088 2.155 . . . . 0.0 105.574 163.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.66 129.92 55.34 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 167.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.405 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -118.7 -169.97 1.82 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 127.083 2.153 . . . . 0.0 108.272 -169.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.24 -43.2 96.28 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.9 mmtp -142.09 25.3 1.93 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.705 1.202 . . . . 0.0 112.367 -177.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -174.49 -170.52 37.78 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mp -135.53 143.54 45.8 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.889 1.276 . . . . 0.0 108.454 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.405 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.4 mt-10 -93.14 141.23 28.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 161.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -127.88 128.4 69.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -117.13 134.59 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 103.955 -2.609 . . . . 0.0 103.955 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.449 HG12 HG23 ' A' ' 62' ' ' ILE . 9.6 m -132.55 134.96 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.2 p -132.34 174.75 9.91 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.682 0.793 . . . . 0.0 110.573 -155.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.3 mttt . . . . . 0 C--N 1.341 0.237 0 C-N-CA 124.714 1.205 . . . . 0.0 111.566 171.89 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ptm . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -130.02 130.22 44.68 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.457 1.503 . . . . 0.0 106.988 -169.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -122.63 153.1 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.967 1.258 . . . . 0.0 108.93 -171.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -142.18 151.73 42.48 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.931 1.292 . . . . 0.0 110.797 173.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -113.88 90.21 3.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.22 1.808 . . . . 0.0 106.504 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.5 mm -58.84 -53.03 53.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.981 0.896 . . . . 0.0 109.03 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -152.58 -166.97 2.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.488 2.315 . . . . 0.0 105.54 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -77.44 1.34 19.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.814 -1.179 . . . . 0.0 113.868 -173.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -129.94 -50.5 1.13 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.436 1.094 . . . . 0.0 111.116 -168.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 76.8 m -82.25 137.55 34.84 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.7 m -128.57 157.72 41.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.855 -1.906 . . . . 0.0 105.855 165.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -133.28 166.98 21.23 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 166.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.0 162.95 39.37 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -124.9 139.62 53.67 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.1 ttt -138.89 103.27 4.76 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -167.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.2 m -64.22 149.79 47.21 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.427 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.8 m-85 -55.13 -32.65 62.22 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -81.36 -11.66 83.05 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.573 -1.126 . . . . 0.0 113.426 -178.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.27 -42.96 82.98 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 120.169 1.984 . . . . 0.0 108.916 167.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -64.08 -45.4 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.13 1.372 . . . . 0.0 108.998 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 122.508 0.323 . . . . 0.0 111.531 -176.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.33 -40.64 97.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.718 0.771 . . . . 0.0 111.251 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtt-85 -65.9 -14.59 61.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 114.86 -1.063 . . . . 0.0 110.925 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.63 9.67 80.87 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 124.959 1.266 . . . . 0.0 112.762 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -83.61 -178.38 7.01 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 171.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -134.24 147.61 50.71 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -58.41 -31.1 67.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.431 -176.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -83.38 -47.14 11.76 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 173.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.05 -35.95 69.95 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.727 0.811 . . . . 0.0 112.522 -172.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -43.9 -55.82 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.465 1.106 . . . . 0.0 109.386 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -75.49 -16.26 60.32 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -172.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -116.92 7.7 13.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.748 0.819 . . . . 0.0 112.68 -166.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -136.51 88.9 2.41 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -48.95 -45.38 41.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -70.73 -30.79 67.41 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.617 -0.677 . . . . 0.0 111.007 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -78.42 -20.66 50.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.765 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.71 -49.3 71.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 167.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -53.49 -34.82 59.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.965 1.306 . . . . 0.0 112.68 -169.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.413 ' H ' ' HG2' ' A' ' 39' ' ' GLU . 1.9 mm-40 -58.19 -33.96 69.84 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.719 1.208 . . . . 0.0 111.389 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -54.07 51.02 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HA ' HG22 ' A' ' 44' ' ' VAL . 73.9 m-85 -67.15 -36.59 82.17 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.029 0.932 . . . . 0.0 110.263 -173.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 m95 -57.37 -36.48 71.29 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.153 -0.927 . . . . 0.0 112.167 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -68.63 -42.48 77.98 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.464 1.484 . . . . 0.0 111.085 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' A' ' 41' ' ' PHE . 13.5 m -75.19 -38.33 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 120.935 -1.103 . . . . 0.0 111.477 -175.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.8 mmt -59.98 -42.76 94.86 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.935 -0.555 . . . . 0.0 109.954 168.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.87 -41.25 82.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.045 0.839 . . . . 0.0 111.532 176.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -59.61 -9.34 2.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.373 1.869 . . . . 0.0 112.806 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -123.81 -8.33 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.25 1.82 . . . . 0.0 110.059 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -58.91 -28.08 65.86 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -163.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.38 -15.04 62.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.482 1.037 . . . . 0.0 112.462 177.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -112.3 -40.85 4.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.812 1.645 . . . . 0.0 109.236 174.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.73 -26.1 65.37 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.51 1.124 . . . . 0.0 112.118 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -57.5 -24.03 53.54 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.079 1.309 . . . . 0.0 112.569 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -78.83 -14.04 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.736 0.815 . . . . 0.0 112.09 176.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.21 8.57 2.47 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -164.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.16 69.1 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.936 1.35 . . . . 0.0 109.759 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -156.88 30.46 0.31 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.757 1.223 . . . . 0.0 110.088 -172.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 -179.88 37.84 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.373 0.987 . . . . 0.0 111.117 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.58 172.06 15.07 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.903 3.069 . . . . 0.0 112.317 -174.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 25.6 tp -135.93 154.32 51.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.404 1.482 . . . . 0.0 107.154 169.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -143.35 149.69 38.1 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.628 1.571 . . . . 0.0 107.256 -171.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mm -134.81 144.07 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.253 0.933 . . . . 0.0 109.728 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -138.57 150.54 46.43 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.638 1.975 . . . . 0.0 107.073 165.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.12 158.35 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.092 -1.005 . . . . 0.0 109.077 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.497 HE22 HD13 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -141.75 151.82 43.23 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 157.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.63 145.1 26.62 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 mp -124.27 -172.46 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.762 2.825 . . . . 0.0 107.714 -174.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.38 -37.84 84.87 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -167.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.7 mmtm -140.97 25.43 2.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.337 1.055 . . . . 0.0 112.569 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.76 -168.82 37.29 Favored Glycine 0 C--O 1.228 -0.255 0 O-C-N 120.98 -1.075 . . . . 0.0 110.551 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mp -135.01 145.34 47.99 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.729 1.211 . . . . 0.0 108.98 177.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -97.98 128.53 44.6 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 162.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.08 128.77 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.497 HD13 HE22 ' A' ' 65' ' ' GLN . 1.5 mp -109.58 142.05 23.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 173.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.53 136.71 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 171.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.4 p -128.21 174.57 9.16 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.179 0.992 . . . . 0.0 110.113 -160.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 70.1 mttt . . . . . 0 CA--C 1.529 0.167 0 C-N-CA 124.969 1.308 . . . . 0.0 110.173 170.698 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptm . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 120.297 0.094 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -133.67 127.89 33.86 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 -170.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.1 mm -125.64 151.05 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.583 1.553 . . . . 0.0 107.957 -174.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -146.0 151.03 37.11 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.345 1.058 . . . . 0.0 110.885 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -112.4 101.98 10.14 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.333 1.853 . . . . 0.0 106.29 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.3 mm -70.17 -55.93 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -177.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -159.22 -170.5 3.01 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.141 1.376 . . . . 0.0 109.702 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.85 -15.74 5.35 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.206 1.403 . . . . 0.0 114.07 -175.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -124.72 -40.77 2.17 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.976 0.911 . . . . 0.0 111.468 -171.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -98.62 139.36 34.44 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 122.161 0.982 . . . . 0.0 109.305 -173.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -124.05 162.12 25.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 165.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.7 pttt -135.02 168.56 18.9 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.577 -0.702 . . . . 0.0 109.395 160.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 44' ' ' VAL . 45.6 p90 -146.44 168.97 19.85 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -132.33 140.0 48.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -135.28 114.47 12.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -170.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -74.52 154.87 38.47 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.486 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-30 -53.98 -32.14 53.03 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 175.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -90.02 -8.05 67.39 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.257 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -47.65 69.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.973 1.886 . . . . 0.0 107.755 162.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.1 mt -56.85 -47.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.179 1.392 . . . . 0.0 108.546 176.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.96 -36.75 80.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 117.971 0.351 . . . . 0.0 111.74 -176.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -64.12 -41.17 97.34 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.58 0.705 . . . . 0.0 110.581 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.34 -4.02 23.84 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.771 1.228 . . . . 0.0 111.153 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.73 7.82 86.83 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.958 1.266 . . . . 0.0 112.634 173.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -84.18 -172.27 4.07 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 168.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -146.09 152.89 40.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -59.07 -33.27 70.6 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 120.168 1.349 . . . . 0.0 111.913 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.12 -48.14 21.77 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -63.16 -33.99 76.66 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 123.507 0.723 . . . . 0.0 112.51 -170.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.86 -56.74 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.036 0.934 . . . . 0.0 108.539 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -77.17 -33.85 56.46 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 121.849 -0.532 . . . . 0.0 111.57 -171.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -89.46 4.44 49.12 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.229 0.611 . . . . 0.0 111.866 -166.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -139.1 88.6 2.29 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -51.45 -38.94 56.21 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -30.57 59.2 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.586 -0.696 . . . . 0.0 111.189 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -80.56 -15.66 56.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.27 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -51.76 66.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 166.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -55.91 -31.13 62.59 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.546 1.538 . . . . 0.0 112.554 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.93 -38.66 76.32 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.897 1.279 . . . . 0.0 111.543 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.421 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -59.54 -51.01 71.7 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.755 0.822 . . . . 0.0 109.223 176.668 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -65.24 -38.95 91.96 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.622 0.769 . . . . 0.0 110.41 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -60.46 -38.5 84.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 118.781 -0.628 . . . . 0.0 111.556 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -74.4 -33.98 63.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.708 1.14 . . . . 0.0 110.79 -174.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 13' ' ' PHE . 17.8 m -72.67 -43.04 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 119.295 0.952 . . . . 0.0 111.635 175.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.0 mmt -55.05 -45.44 75.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.081 0.552 . . . . 0.0 109.61 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.38 -43.81 92.84 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.451 0.3 . . . . 0.0 111.697 176.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -63.95 -13.24 44.44 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.26 1.424 . . . . 0.0 112.491 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 m -120.84 3.18 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.339 1.056 . . . . 0.0 111.586 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -18.84 63.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -164.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.5 -23.47 65.93 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.351 0.978 . . . . 0.0 111.657 173.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -89.2 -8.13 54.21 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.447 1.099 . . . . 0.0 111.21 175.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -124.15 -18.8 5.77 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.418 1.087 . . . . 0.0 112.327 -162.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.68 -26.16 61.29 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.625 1.102 . . . . 0.0 112.179 177.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -83.73 -7.49 59.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.588 1.155 . . . . 0.0 112.651 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.3 7.92 2.0 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.561 1.144 . . . . 0.0 113.515 -166.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.263 7.6 p -79.04 71.1 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 123.077 1.418 . . . . 0.0 109.374 175.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -161.66 37.77 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.89 1.676 . . . . 0.0 108.972 -172.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.31 -173.56 22.69 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.919 1.247 . . . . 0.0 111.188 -173.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.44 179.58 4.96 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.518 2.812 . . . . 0.0 111.311 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.78 135.62 22.28 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -141.95 149.6 40.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.42 1.088 . . . . 0.0 109.084 -171.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.4 mm -132.59 145.91 33.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.896 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -138.71 92.29 2.61 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.412 1.485 . . . . 0.0 107.541 160.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.54 153.95 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.665 0.786 . . . . 0.0 108.884 166.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 152.13 34.07 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 152.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.38 143.36 32.78 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.672 0.789 . . . . 0.0 110.09 -175.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.52 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -130.12 -178.82 4.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.997 2.519 . . . . 0.0 107.914 -173.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.41 -35.04 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -164.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.486 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.1 mmtm -141.94 27.03 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.44 1.096 . . . . 0.0 112.353 178.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.89 -172.46 42.37 Favored Glycine 0 CA--C 1.519 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 110.801 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -136.72 139.45 41.92 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.515 1.126 . . . . 0.0 109.387 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.52 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 15.1 mt-10 -90.89 143.46 26.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 162.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.43 118.9 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.75 146.93 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 168.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.32 119.29 14.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 -174.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -121.02 165.16 15.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.637 0.653 . . . . 0.0 110.057 -163.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.35 0 C-N-CA 125.76 1.624 . . . . 0.0 108.655 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 ptm . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -124.26 77.56 1.57 Allowed 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -158.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 mm -69.61 152.68 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.174 1.39 . . . . 0.0 110.422 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -140.19 149.95 43.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.069 1.747 . . . . 0.0 109.674 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -109.24 107.62 17.93 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.0 mm -73.64 -55.53 12.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.1 p30 -163.34 -175.76 4.42 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.297 1.839 . . . . 0.0 107.373 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.3 -24.32 59.18 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.381 -1.45 . . . . 0.0 113.04 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -102.3 -25.75 13.55 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.944 0.897 . . . . 0.0 111.851 -169.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 75.6 m -128.04 137.07 52.04 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.247 1.022 . . . . 0.0 108.523 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 m -123.44 156.59 29.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 105.505 -2.035 . . . . 0.0 105.505 166.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 pttt -135.51 168.93 18.33 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 161.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -153.71 161.1 42.42 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -110.67 143.98 40.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 166.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -139.45 108.81 6.13 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 152.37 45.48 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.449 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.6 m-85 -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.02 0.528 . . . . 0.0 112.221 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.19 -25.44 69.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.058 -0.857 . . . . 0.0 113.402 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.82 -38.94 80.22 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.301 1.551 . . . . 0.0 109.64 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.2 mt -71.37 -42.27 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 125.016 1.326 . . . . 0.0 108.319 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.27 -39.55 90.8 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.787 1.235 . . . . 0.0 111.458 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -62.96 -42.1 99.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.624 0.726 . . . . 0.0 111.132 -177.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.8 mtt-85 -68.43 -11.52 59.82 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.221 173.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.55 12.34 84.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.613 1.102 . . . . 0.0 113.243 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -82.73 -175.07 5.6 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 167.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -137.2 152.83 50.32 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 170.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.8 ptt-85 -59.04 -27.69 65.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.797 1.239 . . . . 0.0 113.259 -175.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -91.52 -43.75 9.49 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.65 -34.16 70.9 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 124.245 1.018 . . . . 0.0 112.314 -174.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -44.17 -56.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 124.474 1.11 . . . . 0.0 109.128 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -74.62 -34.44 62.8 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.118 0.567 . . . . 0.0 112.06 -172.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -94.14 7.68 44.35 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -168.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -134.73 89.94 2.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -52.38 -37.42 56.29 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -164.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -32.43 58.92 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.775 0.43 . . . . 0.0 111.704 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -76.66 -20.05 57.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.898 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.3 -50.84 70.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 168.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -35.01 62.21 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.92 1.288 . . . . 0.0 112.781 -169.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -58.12 -34.92 70.75 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.371 1.068 . . . . 0.0 111.193 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -54.8 42.62 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.074 0.95 . . . . 0.0 108.707 174.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.401 ' HA ' HG22 ' A' ' 44' ' ' VAL . 78.5 m-85 -64.85 -38.1 89.85 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.115 0.966 . . . . 0.0 110.181 -174.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -60.74 -37.8 83.0 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.344 -0.836 . . . . 0.0 112.584 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.54 -38.39 80.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 120.363 1.438 . . . . 0.0 111.513 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.401 HG22 ' HA ' ' A' ' 41' ' ' PHE . 18.9 m -74.04 -42.01 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 121.008 -1.057 . . . . 0.0 111.677 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.04 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.856 0.462 . . . . 0.0 109.959 168.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.19 -38.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 118.06 0.391 . . . . 0.0 111.788 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.16 -13.14 15.69 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.653 1.181 . . . . 0.0 112.993 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.96 16.05 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 124.98 1.312 . . . . 0.0 111.691 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -23.99 67.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.409 -0.807 . . . . 0.0 112.328 -169.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.53 -25.82 67.54 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -91.45 -44.92 8.83 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.54 0.736 . . . . 0.0 109.261 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -64.97 -26.78 68.44 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 118.314 -0.851 . . . . 0.0 112.187 -172.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -61.31 -9.85 5.96 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 120.338 1.426 . . . . 0.0 112.785 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.68 -0.77 11.74 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.578 1.551 . . . . 0.0 111.9 173.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.97 3.87 1.25 Allowed 'General case' 0 C--N 1.342 0.254 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -166.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.267 7.9 p -81.32 57.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 120.254 1.388 . . . . 0.0 109.664 173.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -83.6 12.59 5.54 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.47 1.108 . . . . 0.0 112.361 -166.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.95 177.34 42.79 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.65 1.119 . . . . 0.0 110.635 -177.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.42 167.53 26.08 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.001 3.134 . . . . 0.0 111.017 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.91 147.98 49.56 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.42 0.629 . . . . 0.0 109.433 171.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -147.79 142.43 26.59 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 128.286 2.634 . . . . 0.0 104.296 173.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.572 HD12 ' N ' ' A' ' 63' ' ' GLN . 0.5 OUTLIER -144.15 152.55 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 120.309 1.413 . . . . 0.0 110.742 -175.225 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.572 ' N ' HD12 ' A' ' 62' ' ' ILE . 46.0 tt0 -137.83 148.93 45.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.384 1.874 . . . . 0.0 106.697 170.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 p -141.42 160.2 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 O-C-N 120.46 -1.4 . . . . 0.0 109.459 -176.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.408 HE22 HD13 ' A' ' 74' ' ' ILE . 0.4 OUTLIER -142.72 152.19 42.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 158.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.46 141.68 34.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -124.58 -174.84 3.12 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.927 2.491 . . . . 0.0 107.831 -172.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.29 -37.93 82.05 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -166.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 75.1 mmtt -140.45 25.67 2.2 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.339 1.056 . . . . 0.0 111.673 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.53 -170.4 39.08 Favored Glycine 0 C--O 1.227 -0.321 0 O-C-N 121.101 -1.0 . . . . 0.0 110.972 -174.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.16 146.27 44.75 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.803 1.241 . . . . 0.0 108.848 177.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -97.47 129.42 44.66 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 161.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.479 HG23 HD13 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -117.57 128.46 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 105.183 -2.154 . . . . 0.0 105.183 179.718 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.408 HD13 HE22 ' A' ' 65' ' ' GLN . 1.7 mp -103.56 145.16 13.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.03 134.87 42.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.5 p -134.02 175.9 9.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.677 0.791 . . . . 0.0 109.82 -164.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.8 mppt? . . . . . 0 CA--C 1.533 0.318 0 C-N-CA 125.517 1.527 . . . . 0.0 108.644 171.985 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -139.78 78.72 1.68 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -145.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 mm -67.6 153.69 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 124.142 0.977 . . . . 0.0 109.404 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.92 152.65 42.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.731 1.613 . . . . 0.0 110.303 172.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.5 tpp85 -114.69 90.95 3.46 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.912 1.685 . . . . 0.0 106.758 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.42 -53.23 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 122.023 0.916 . . . . 0.0 109.019 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -151.45 -168.76 3.18 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.597 2.359 . . . . 0.0 105.558 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -77.84 5.18 10.1 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.084 -1.01 . . . . 0.0 113.69 -172.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -130.68 -55.14 1.07 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.289 1.036 . . . . 0.0 110.682 -171.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -77.38 138.6 39.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 171.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -125.36 160.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 166.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.2 pttt -134.29 168.95 17.95 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 160.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.0 142.42 25.23 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 170.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -94.05 137.94 32.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 165.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.4 ttt -131.24 116.71 18.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -174.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -76.27 154.06 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.405 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -56.66 -39.06 73.08 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.524 -0.735 . . . . 0.0 112.209 177.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.54 -24.61 73.88 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.763 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -28.63 64.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.083 1.442 . . . . 0.0 110.627 174.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.54 -43.45 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.825 1.25 . . . . 0.0 107.661 178.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.17 -39.58 82.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.565 1.146 . . . . 0.0 111.327 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.13 -45.25 92.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.247 1.019 . . . . 0.0 111.276 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.7 mtt85 -69.03 -6.89 30.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.341 1.056 . . . . 0.0 111.527 172.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.65 12.91 84.03 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.547 1.07 . . . . 0.0 113.194 176.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.69 -174.06 4.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 167.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -139.05 149.69 44.9 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.1 ptt180 -62.38 -31.4 72.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -168.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.54 -44.1 12.95 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 173.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.62 -35.92 68.85 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.309 1.044 . . . . 0.0 112.69 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.1 mm -43.51 -50.98 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 124.791 1.236 . . . . 0.0 110.683 169.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.4 m95 -80.22 -12.95 59.58 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.259 1.024 . . . . 0.0 113.55 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -123.03 7.28 9.24 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -166.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -124.98 99.41 6.12 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 172.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 46.2 ptt85 -60.27 -14.29 17.26 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -163.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -30.37 7.32 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.563 1.545 . . . . 0.0 111.891 178.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -79.53 -14.96 58.51 Favored 'General case' 0 C--N 1.339 0.151 0 O-C-N 121.3 -0.875 . . . . 0.0 111.322 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.5 p -52.19 -57.5 9.45 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.171 0.989 . . . . 0.0 109.533 163.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.48 -32.06 64.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.232 1.813 . . . . 0.0 112.522 -167.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.2 mm-40 -60.01 -34.8 73.84 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.661 1.185 . . . . 0.0 111.219 -176.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -51.94 67.76 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 174.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -66.18 -38.43 88.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.429 0.691 . . . . 0.0 109.924 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -58.34 -37.55 75.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.627 -0.702 . . . . 0.0 112.097 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -64.39 -39.68 94.32 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.022 1.283 . . . . 0.0 111.134 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.8 m -82.47 -39.39 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 O-C-N 121.086 -1.009 . . . . 0.0 112.33 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 mmt -53.14 -47.07 69.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.408 0.683 . . . . 0.0 109.422 166.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.84 -42.0 78.89 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.575 0.625 . . . . 0.0 111.84 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -59.73 -14.86 16.15 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.082 1.353 . . . . 0.0 113.08 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 m -129.76 2.75 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 C-N-CA 124.396 1.078 . . . . 0.0 111.976 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -24.32 67.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -162.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.82 -15.94 35.54 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.66 0.664 . . . . 0.0 112.115 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -113.38 3.14 15.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.868 1.667 . . . . 0.0 110.957 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -115.18 -21.34 10.0 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.228 1.411 . . . . 0.0 111.346 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.31 -15.84 18.38 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -176.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -112.67 6.48 18.26 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.003 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -136.37 0.92 2.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.157 1.383 . . . . 0.0 113.217 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -78.29 73.17 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 122.947 1.356 . . . . 0.0 109.415 172.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -153.64 32.42 0.45 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.012 1.325 . . . . 0.0 109.555 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.13 -178.16 35.78 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.084 1.326 . . . . 0.0 110.84 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -71.91 171.15 17.19 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.7 2.933 . . . . 0.0 112.197 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.93 152.08 46.08 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.588 1.555 . . . . 0.0 107.121 171.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -144.11 150.51 38.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.96 1.304 . . . . 0.0 107.683 -168.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mm -135.0 144.72 33.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -172.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.63 170.59 15.56 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 148.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.27 159.6 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.513 -0.742 . . . . 0.0 110.702 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -129.18 145.37 51.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.751 2.42 . . . . 0.0 105.409 167.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.42 132.0 54.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 168.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.14 -169.81 1.86 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.415 2.286 . . . . 0.0 108.496 -170.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.87 -41.84 98.34 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -169.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.0 mmtp -140.11 22.9 2.41 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.697 1.199 . . . . 0.0 112.445 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.19 -168.44 36.38 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mp -135.62 146.77 48.23 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.462 1.505 . . . . 0.0 108.725 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -100.83 122.67 43.81 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 164.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.73 127.25 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -109.93 142.1 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.17 115.14 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -170.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -117.24 171.04 8.22 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.582 0.628 . . . . 0.0 110.435 -163.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 68.8 mttt . . . . . 0 C--O 1.233 0.226 0 C-N-CA 125.237 1.415 . . . . 0.0 109.768 170.003 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.977 0.418 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -127.49 74.97 1.56 Allowed 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 -149.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 mm -69.29 152.56 9.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.106 1.362 . . . . 0.0 110.167 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.64 152.42 45.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.437 1.895 . . . . 0.0 109.869 172.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.9 tpp85 -118.29 91.61 3.61 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.178 1.791 . . . . 0.0 106.185 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.33 -53.38 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.4 p30 -156.92 -166.88 2.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.787 2.035 . . . . 0.0 106.54 175.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.17 2.58 23.68 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.748 -1.22 . . . . 0.0 113.886 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -129.66 -29.2 2.18 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.164 1.386 . . . . 0.0 111.894 -169.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 62.9 m -111.53 133.07 54.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.526 1.53 . . . . 0.0 107.849 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.7 m -122.65 159.25 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 165.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -139.26 172.19 13.18 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 161.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 35.9 p90 -150.49 169.81 20.6 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 169.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -122.5 144.23 49.21 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 167.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -137.48 114.89 11.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 -173.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.24 158.08 35.87 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.3 m-30 -53.01 -39.07 62.87 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.549 -0.72 . . . . 0.0 111.982 172.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.31 -25.74 73.58 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.451 -0.638 . . . . 0.0 113.051 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -34.53 76.55 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.979 1.389 . . . . 0.0 110.027 173.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 32.4 mt -76.88 -43.1 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.843 1.257 . . . . 0.0 107.907 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.83 -40.77 80.84 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.075 1.35 . . . . 0.0 111.397 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.31 -43.37 98.99 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.594 0.758 . . . . 0.0 111.312 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.1 mtt85 -70.85 -7.55 46.29 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.46 174.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 13.0 84.08 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.695 1.141 . . . . 0.0 112.952 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -82.41 -175.02 5.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.427 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.3 t70 -140.1 147.43 40.24 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -54.76 -38.06 66.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.232 0.924 . . . . 0.0 111.04 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -75.6 -45.0 40.09 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.427 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.6 mm-40 -61.1 -38.22 85.54 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.319 -0.863 . . . . 0.0 111.331 -173.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -54.95 -45.49 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 123.796 0.839 . . . . 0.0 109.773 171.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -69.03 -22.68 64.03 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.488 1.04 . . . . 0.0 112.974 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -120.46 3.93 10.73 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -161.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -137.79 82.4 1.92 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -47.7 -42.3 24.63 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -166.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -31.59 63.99 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.66 -0.65 . . . . 0.0 111.417 -178.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.57 -20.41 54.09 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.96 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -52.08 64.66 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 166.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.8 -32.33 60.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.303 1.441 . . . . 0.0 113.092 -168.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.92 -37.63 69.18 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.539 1.136 . . . . 0.0 111.671 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.458 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -61.32 -50.08 74.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.493 0.717 . . . . 0.0 109.689 177.573 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -65.16 -38.41 90.47 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.531 0.732 . . . . 0.0 109.573 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -59.87 -34.88 73.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.095 171.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.8 -40.49 69.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 120.622 1.556 . . . . 0.0 110.529 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.4 m -70.88 -41.26 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.258 -0.901 . . . . 0.0 110.927 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.2 mmt -57.95 -42.67 85.43 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.113 0.565 . . . . 0.0 110.49 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.0 -41.3 97.9 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.757 0.708 . . . . 0.0 111.779 176.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -63.37 -13.19 36.69 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.636 1.574 . . . . 0.0 111.864 174.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.5 t -109.66 -5.08 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.983 1.713 . . . . 0.0 109.655 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -56.43 -31.08 63.59 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -161.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.52 -14.67 58.52 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.225 0.92 . . . . 0.0 112.94 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -114.26 -36.9 4.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.99 1.716 . . . . 0.0 109.923 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.87 -28.02 65.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.699 1.199 . . . . 0.0 111.521 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.21 -24.93 57.86 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.405 1.002 . . . . 0.0 112.609 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -83.14 -9.89 58.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.073 0.949 . . . . 0.0 111.983 177.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -135.49 8.64 3.37 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 0.0 113.149 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.6 p -84.68 61.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 123.269 1.509 . . . . 0.0 109.15 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -156.08 31.69 0.34 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.676 1.19 . . . . 0.0 109.457 -171.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -173.87 -177.35 43.01 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.996 1.76 . . . . 0.0 109.328 -172.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.23 173.29 11.61 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.466 2.778 . . . . 0.0 112.116 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.3 tp -138.23 150.06 46.36 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 170.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -142.98 149.73 38.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.547 1.139 . . . . 0.0 107.974 -170.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mm -134.31 144.76 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -171.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -142.9 151.62 41.21 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 162.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.7 p -145.22 158.63 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.455 -1.403 . . . . 0.0 109.821 -166.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -136.32 152.21 50.43 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.58 133.18 49.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 158.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.544 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -123.51 178.26 5.26 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.544 1.938 . . . . 0.0 108.099 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.13 -31.85 70.46 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -165.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.536 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.5 mmtm -140.68 21.81 2.33 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.426 1.09 . . . . 0.0 112.656 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.29 -168.27 36.83 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 120.841 -1.162 . . . . 0.0 111.637 -174.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.7 mp -133.08 138.98 46.91 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.285 1.834 . . . . 0.0 107.4 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.544 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 28.4 mt-10 -94.6 143.95 26.0 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 157.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.6 mt -141.62 121.66 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -107.37 142.6 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.53 129.09 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -134.23 168.5 18.75 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.923 0.783 . . . . 0.0 111.26 -163.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.0 mttm . . . . . 0 C--O 1.236 0.364 0 C-N-CA 126.047 1.739 . . . . 0.0 109.787 168.145 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptm . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 110.851 -0.055 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -132.26 127.88 36.66 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -168.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.8 mm -123.77 151.15 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 125.083 1.353 . . . . 0.0 107.976 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -148.31 130.03 15.08 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.595 0.758 . . . . 0.0 110.827 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -88.45 110.78 21.11 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.433 HD11 ' HG2' ' A' ' 12' ' ' LYS . 27.1 mm -74.47 -58.16 5.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.239 0 N-CA-C 108.488 -0.931 . . . . 0.0 108.488 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -157.62 -173.98 4.65 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.605 1.562 . . . . 0.0 108.787 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -56.38 -14.81 3.23 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -174.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -121.09 -46.69 2.31 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.795 1.238 . . . . 0.0 110.879 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.1 m -94.7 142.3 27.61 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.93 0.872 . . . . 0.0 109.621 -172.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.8 m -126.13 163.72 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 166.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.433 ' HG2' HD11 ' A' ' 6' ' ' ILE . 48.2 pttt -134.04 169.13 17.59 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.496 -0.752 . . . . 0.0 109.243 160.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -147.07 167.09 24.96 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 123.831 0.853 . . . . 0.0 108.699 172.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -132.97 143.58 49.55 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 170.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.3 ttt -141.8 112.02 6.93 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -168.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.91 156.06 40.06 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 175.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -55.33 -40.5 71.26 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.389 -0.819 . . . . 0.0 111.978 176.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.86 -12.98 84.08 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 118.612 -1.105 . . . . 0.0 113.769 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.02 -33.74 76.49 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.858 1.829 . . . . 0.0 109.282 166.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.5 mt -77.81 -40.9 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.96 -37.16 81.43 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.207 0.458 . . . . 0.0 111.584 175.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -64.5 -42.43 95.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.87 0.843 . . . . 0.0 111.182 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.6 mtt85 -70.1 -8.02 46.14 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.37 -1.286 . . . . 0.0 111.386 173.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.09 12.81 84.29 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.492 1.044 . . . . 0.0 112.988 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -83.6 -171.87 3.83 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 165.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -139.61 148.17 42.11 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.5 ptt85 -57.96 -31.05 66.49 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 118.77 -0.633 . . . . 0.0 112.064 -177.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -83.1 -46.07 13.23 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.35 -36.46 68.81 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.811 0.844 . . . . 0.0 112.472 -173.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mm -46.03 -48.97 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.508 1.123 . . . . 0.0 110.342 171.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -80.45 -13.35 59.19 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.939 1.088 . . . . 0.0 113.939 -175.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -122.01 10.87 10.19 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.046 0.839 . . . . 0.0 112.731 -166.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -133.63 99.26 4.43 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -58.75 -15.61 12.91 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -164.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.4 -30.83 7.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.463 1.505 . . . . 0.0 111.708 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -78.5 -15.7 58.31 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 118.923 0.783 . . . . 0.0 111.597 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 p -53.56 -60.69 2.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.036 0.935 . . . . 0.0 109.477 164.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -58.46 -29.15 65.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.854 1.662 . . . . 0.0 112.454 -165.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.12 -38.15 73.04 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.728 1.211 . . . . 0.0 111.394 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.424 ' C ' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.2 -55.59 32.96 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.164 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -63.02 -35.98 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.565 1.146 . . . . 0.0 110.635 -175.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.7 m95 -63.8 -38.4 90.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.686 -1.149 . . . . 0.0 112.018 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -68.62 -45.54 71.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.737 1.608 . . . . 0.0 109.868 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.6 -45.97 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 O-C-N 121.489 -0.757 . . . . 0.0 110.581 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.5 tpp -61.85 -37.05 83.04 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.868 -0.52 . . . . 0.0 109.946 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -64.92 -41.86 95.19 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.074 0.852 . . . . 0.0 111.511 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.96 -41.48 98.04 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.549 1.14 . . . . 0.0 110.186 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.7 t -73.5 -16.87 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.685 1.194 . . . . 0.0 111.174 176.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -58.15 -26.31 62.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.68 1.582 . . . . 0.0 115.22 -157.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -58.9 -22.71 60.01 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.608 1.095 . . . . 0.0 112.122 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -95.16 -2.14 50.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.326 1.45 . . . . 0.0 111.615 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -134.09 -16.73 2.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.361 1.065 . . . . 0.0 112.567 -161.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.82 -17.43 36.07 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.447 1.099 . . . . 0.0 113.44 -178.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -107.17 3.69 25.96 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.703 1.601 . . . . 0.0 111.684 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.54 18.75 2.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.43 1.492 . . . . 0.0 112.14 -175.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.3 p -92.07 73.26 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.856 1.312 . . . . 0.0 107.694 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -152.96 31.78 0.49 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.004 -172.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.72 -179.22 37.16 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.061 1.315 . . . . 0.0 110.467 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -71.83 170.32 19.06 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.521 2.814 . . . . 0.0 112.001 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 49.1 mt -135.45 155.53 50.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.501 1.52 . . . . 0.0 107.731 171.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -150.62 147.22 27.14 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.441 1.497 . . . . 0.0 107.201 -162.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 8.4 mm -131.81 141.27 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -136.73 88.89 2.4 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.706 1.602 . . . . 0.0 106.798 167.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.21 154.41 8.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 166.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.66 152.3 33.78 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 152.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.0 143.36 33.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 109.617 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.527 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -129.51 -175.83 3.71 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 127.947 2.499 . . . . 0.0 107.898 -171.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.0 -38.25 82.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -164.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.47 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.8 mmtm -142.3 28.15 1.69 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.557 1.143 . . . . 0.0 111.746 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.13 -172.61 41.04 Favored Glycine 0 CA--C 1.517 0.165 0 O-C-N 121.14 -0.975 . . . . 0.0 110.876 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.58 139.77 44.12 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 124.392 1.077 . . . . 0.0 109.447 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.527 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 18.9 mt-10 -90.79 145.74 24.54 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 161.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.0 mt -134.97 122.59 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 106.789 -1.559 . . . . 0.0 106.789 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -93.99 146.57 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 169.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.7 118.24 11.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 -171.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -124.55 173.87 8.19 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.81 0.732 . . . . 0.0 111.44 -159.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.5 mttt . . . . . 0 C--N 1.342 0.257 0 C-N-CA 125.179 1.392 . . . . 0.0 109.972 165.398 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.551 0.204 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -135.62 130.88 35.07 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 125.418 1.487 . . . . 0.0 106.998 -170.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.8 mm -122.39 152.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.51 1.524 . . . . 0.0 108.646 -173.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -143.92 149.29 36.63 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.21 1.404 . . . . 0.0 110.617 169.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -112.5 102.4 10.51 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.7 mm -70.98 -55.3 14.53 Favored 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.2 p30 -163.03 -170.39 2.31 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.99 1.716 . . . . 0.0 107.863 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.19 -20.05 63.77 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.729 -1.232 . . . . 0.0 112.509 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -108.25 -30.4 8.38 Favored 'General case' 0 CA--C 1.522 -0.103 0 O-C-N 121.136 -0.977 . . . . 0.0 111.606 -163.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.6 m -123.1 138.72 54.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.788 1.235 . . . . 0.0 108.755 -178.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -125.92 157.25 35.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 162.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -135.38 167.45 21.02 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 166.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.544 ' CE1' HG21 ' A' ' 44' ' ' VAL . 55.2 p90 -152.68 167.95 27.27 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -130.31 137.07 49.76 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 tpt -132.88 106.76 7.9 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -168.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -68.4 156.29 38.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 175.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.46 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.6 m-85 -55.66 -37.02 67.73 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.487 -0.758 . . . . 0.0 111.425 173.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.05 -32.33 83.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.371 -0.683 . . . . 0.0 112.723 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -40.17 85.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.173 1.486 . . . . 0.0 110.05 177.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 31.6 mt -67.0 -49.28 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.827 1.251 . . . . 0.0 109.116 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -59.63 -38.18 80.65 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 126.042 1.737 . . . . 0.0 111.293 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.76 -40.2 91.82 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.034 0.921 . . . . 0.0 110.521 -175.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -70.57 -7.95 47.85 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.282 -1.326 . . . . 0.0 111.611 173.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.42 10.31 84.72 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.926 1.25 . . . . 0.0 113.234 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -84.04 -178.5 6.99 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 168.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.47 151.14 45.96 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.024 -1.047 . . . . 0.0 108.562 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -62.95 -31.22 72.27 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -166.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.54 -42.37 13.58 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -60.53 -34.82 74.67 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 123.729 0.812 . . . . 0.0 112.175 -172.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.4 mm -41.75 -57.26 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.418 1.087 . . . . 0.0 109.137 167.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.411 ' CZ2' HG21 ' A' ' 64' ' ' VAL . 63.0 m95 -73.17 -38.68 66.1 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.821 0.449 . . . . 0.0 111.664 -173.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -89.34 4.14 49.88 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -169.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -130.74 84.31 2.18 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -51.6 -41.87 61.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.394 -0.816 . . . . 0.0 112.687 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -28.48 66.71 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.49 -0.756 . . . . 0.0 111.712 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -81.61 -18.45 44.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.417 -0.802 . . . . 0.0 111.299 175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.33 -46.69 85.47 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 163.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.537 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 8.6 tt0 -53.89 -32.91 54.96 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.213 1.005 . . . . 0.0 113.415 -171.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.427 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 1.0 OUTLIER -67.25 -32.71 73.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.422 1.489 . . . . 0.0 111.028 -176.326 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -47.34 85.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 1.4 m-30 -68.97 -43.31 75.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.295 1.038 . . . . 0.0 109.521 -173.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -54.91 -39.47 68.83 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.471 -0.776 . . . . 0.0 111.533 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.8 -39.2 90.7 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.557 1.071 . . . . 0.0 111.333 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.544 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.5 m -78.39 -39.19 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.002 -1.061 . . . . 0.0 112.02 -174.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.5 mmm -55.32 -48.11 74.63 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.3 -38.23 79.72 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.39 -16.57 9.48 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.439 1.495 . . . . 0.0 112.733 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 m -135.87 12.01 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 125.386 1.474 . . . . 0.0 111.117 -173.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -21.45 62.59 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -160.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -58.71 -28.34 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.996 0.918 . . . . 0.0 111.254 174.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -90.63 3.15 54.94 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.363 1.465 . . . . 0.0 111.327 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -134.31 -24.81 1.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 O-C-N 121.237 -0.914 . . . . 0.0 112.822 -161.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -57.28 -22.93 45.02 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.106 0.963 . . . . 0.0 113.134 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -95.53 4.52 53.11 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.115 1.366 . . . . 0.0 112.359 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.25 -24.46 2.07 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.444 1.098 . . . . 0.0 113.153 -175.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -73.43 1.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 120.142 1.337 . . . . 0.0 113.336 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -56.7 -18.53 12.69 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.123 1.369 . . . . 0.0 113.366 156.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.57 -173.44 23.04 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.433 1.492 . . . . 0.0 111.911 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.46 171.69 12.57 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.421 2.747 . . . . 0.0 111.832 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.434 HD13 ' H ' ' A' ' 61' ' ' TRP . 0.1 OUTLIER -137.98 152.1 48.58 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.346 1.459 . . . . 0.0 107.442 175.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.434 ' H ' HD13 ' A' ' 60' ' ' LEU . 95.3 m95 -147.85 145.04 28.55 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 125.598 1.559 . . . . 0.0 107.615 -164.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -133.79 141.28 44.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -138.24 159.39 42.17 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.77 2.028 . . . . 0.0 107.27 167.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.411 HG21 ' CZ2' ' A' ' 31' ' ' TRP . 7.1 p -146.87 162.53 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 120.553 -1.342 . . . . 0.0 110.968 -170.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.36 149.01 52.44 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 126.862 2.065 . . . . 0.0 106.041 160.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.07 129.59 55.47 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 167.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.421 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 5.0 mp -118.9 -175.3 2.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 108.319 -170.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.28 -35.52 80.61 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -166.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.5 mmtm -141.42 23.93 2.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.346 1.059 . . . . 0.0 112.124 -178.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.05 -171.4 40.58 Favored Glycine 0 N--CA 1.454 -0.138 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mp -136.77 143.08 43.04 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.432 1.093 . . . . 0.0 108.341 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.421 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.5 mt-10 -90.25 141.46 28.69 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 161.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.405 HD12 ' C ' ' A' ' 72' ' ' GLU . 0.7 OUTLIER -127.98 132.36 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 175.197 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -112.5 139.05 39.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 104.406 -2.442 . . . . 0.0 104.406 177.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.26 142.22 41.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 119.302 0.955 . . . . 0.0 109.935 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -136.86 170.86 15.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.411 0.684 . . . . 0.0 110.193 -159.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 124.862 1.265 . . . . 0.0 108.9 169.331 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.498 1.963 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -130.2 127.06 38.9 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -170.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 mm -121.55 150.43 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.876 1.27 . . . . 0.0 108.861 -170.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -146.45 150.4 35.55 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.047 1.339 . . . . 0.0 109.923 172.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.17 99.83 6.27 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -179.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -71.1 -56.09 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -168.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.0 p30 -156.27 -168.09 2.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.476 1.51 . . . . 0.0 108.376 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.4 -17.1 58.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -117.3 -53.65 2.43 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.166 -0.959 . . . . 0.0 109.671 -167.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 44.9 m -86.55 138.06 32.02 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.81 0.844 . . . . 0.0 109.48 177.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.5 m -131.65 158.98 43.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 165.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -144.32 170.38 16.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.933 -1.105 . . . . 0.0 109.975 170.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.434 ' CE1' HG21 ' A' ' 44' ' ' VAL . 53.7 p90 -151.93 167.76 27.33 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -128.92 141.08 51.39 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 173.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.4 ttt -140.8 105.67 4.95 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -167.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.1 m -65.79 149.86 49.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.427 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.2 m-85 -55.88 -32.89 64.1 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.5 -7.58 81.98 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 118.572 -1.126 . . . . 0.0 113.362 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -66.87 -49.04 66.92 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.26 2.03 . . . . 0.0 107.958 164.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.36 -46.43 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.197 1.399 . . . . 0.0 108.855 177.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.71 -36.29 80.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.328 0.251 . . . . 0.0 111.397 -176.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.39 -40.69 85.69 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.493 0.717 . . . . 0.0 111.027 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.7 mtp85 -64.07 -14.97 58.4 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.988 -1.005 . . . . 0.0 111.703 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.05 7.19 80.94 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.33 -0.705 . . . . 0.0 113.18 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -80.45 -174.88 4.87 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 166.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -138.79 148.4 43.77 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -59.08 -30.68 68.25 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.595 0.634 . . . . 0.0 112.469 -174.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -82.69 -48.78 10.5 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.33 -36.61 66.44 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.989 0.916 . . . . 0.0 112.919 -171.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -44.29 -54.76 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 124.391 1.076 . . . . 0.0 109.354 170.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -76.95 -11.96 59.88 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -121.76 7.24 9.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.695 0.798 . . . . 0.0 112.84 -167.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -136.66 87.04 2.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.473 -2.047 . . . . 0.0 105.473 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -51.12 -38.14 50.13 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -164.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.28 -32.13 58.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.614 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -79.53 -18.1 52.6 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.286 176.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -48.99 75.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 166.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -53.27 -34.74 58.49 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.292 1.437 . . . . 0.0 112.696 -169.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.424 ' H ' ' HG2' ' A' ' 39' ' ' GLU . 2.1 mm-40 -59.26 -32.98 70.5 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.377 1.471 . . . . 0.0 111.315 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.409 HD21 ' CE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -58.2 -57.84 11.09 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.418 1.087 . . . . 0.0 108.328 173.174 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HA ' HG22 ' A' ' 44' ' ' VAL . 75.9 m-85 -63.98 -36.73 84.94 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.848 1.259 . . . . 0.0 110.918 -172.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -56.11 -44.23 78.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.778 172.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.23 -41.54 76.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.498 1.045 . . . . 0.0 111.279 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.434 HG21 ' CE1' ' A' ' 13' ' ' PHE . 17.6 m -70.96 -43.21 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 121.217 -0.927 . . . . 0.0 111.389 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 50.5 tpp -56.8 -43.28 80.78 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 123.621 0.768 . . . . 0.0 109.056 172.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.55 -40.26 94.05 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.457 -0.777 . . . . 0.0 111.925 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.72 -9.45 9.25 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.604 1.561 . . . . 0.0 112.896 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.451 HG23 ' HG3' ' A' ' 52' ' ' GLU . 22.6 m -128.92 6.21 2.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 C-N-CA 124.614 1.166 . . . . 0.0 111.431 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -26.31 64.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -164.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -60.23 -22.79 63.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.986 0.914 . . . . 0.0 112.209 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -103.94 -3.23 25.0 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.167 1.387 . . . . 0.0 111.372 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.451 ' HG3' HG23 ' A' ' 48' ' ' VAL . 77.6 mm-40 -121.61 -14.8 8.11 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.222 1.009 . . . . 0.0 112.097 -169.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.64 -25.59 53.83 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.126 0.876 . . . . 0.0 112.746 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -76.24 -21.45 56.35 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.764 0.826 . . . . 0.0 112.351 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -127.21 -2.35 6.35 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 124.731 1.212 . . . . 0.0 113.646 -162.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.7 p -77.48 64.6 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 123.24 1.495 . . . . 0.0 110.329 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -159.97 35.92 0.18 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.302 1.441 . . . . 0.0 108.877 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.1 -175.93 33.64 Favored Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.819 1.676 . . . . 0.0 110.377 -173.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.28 172.22 11.5 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.53 2.82 . . . . 0.0 111.442 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.4 tp -137.79 150.62 47.36 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 173.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -143.02 147.03 34.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.075 1.35 . . . . 0.0 107.538 -170.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.9 mm -132.18 144.85 35.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -136.22 154.51 50.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.071 1.748 . . . . 0.0 106.612 162.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -140.03 160.38 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 O-C-N 121.014 -1.053 . . . . 0.0 109.801 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.76 147.25 52.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.862 2.065 . . . . 0.0 105.519 162.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.53 128.47 55.21 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 167.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.429 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -117.76 -172.82 2.31 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.616 2.366 . . . . 0.0 108.021 -169.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.92 -38.58 88.96 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.323 -0.861 . . . . 0.0 113.303 -166.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.4 mmtm -141.34 25.4 2.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.653 1.181 . . . . 0.0 112.298 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.54 -169.44 37.93 Favored Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mp -135.78 144.2 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.457 1.103 . . . . 0.0 108.437 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.429 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 26.1 mt-10 -92.61 140.6 29.38 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 160.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.403 HD12 ' C ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -128.47 127.9 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 104.443 -2.428 . . . . 0.0 104.443 175.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -108.89 143.66 18.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 104.776 -2.305 . . . . 0.0 104.776 176.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 131.7 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 -172.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -135.31 167.96 20.07 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.619 0.645 . . . . 0.0 110.206 -167.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? . . . . . 0 N--CA 1.468 0.447 0 C-N-CA 126.492 1.917 . . . . 0.0 107.726 175.54 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 111.412 0.153 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.28 130.49 44.6 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 125.33 1.452 . . . . 0.0 107.154 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 mm -123.63 151.22 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 120.175 1.352 . . . . 0.0 108.889 -170.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -143.37 151.2 40.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.703 1.601 . . . . 0.0 109.484 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.12 93.5 3.83 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm -66.2 -54.46 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -170.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -155.72 -160.81 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.538 1.535 . . . . 0.0 108.706 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -72.13 -10.96 60.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -175.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -130.74 -40.81 1.2 Allowed 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.273 -0.892 . . . . 0.0 111.686 -166.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.7 m -91.65 132.51 36.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.5 m -135.99 155.94 36.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 164.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.2 pttt -140.4 168.78 18.99 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.29 -0.882 . . . . 0.0 109.82 176.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -149.56 164.67 34.45 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 175.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -125.69 141.21 52.13 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 173.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.7 ttt -139.65 104.95 5.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -167.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -67.04 148.96 51.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-85 -51.83 -42.12 62.31 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.51 -11.88 80.21 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.412 -1.216 . . . . 0.0 113.842 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.9 -41.33 95.69 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.905 1.852 . . . . 0.0 109.214 166.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.3 mt -71.65 -40.98 71.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.179 1.391 . . . . 0.0 108.177 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.52 -35.67 80.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.156 0.435 . . . . 0.0 111.655 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -65.08 -40.46 94.65 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.91 0.862 . . . . 0.0 111.188 -175.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 56.8 mtt-85 -67.02 -15.18 63.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.847 1.259 . . . . 0.0 110.783 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.09 11.18 82.82 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.893 1.235 . . . . 0.0 113.055 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -83.7 -175.31 5.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 170.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -139.04 153.96 48.16 Favored 'General case' 0 CA--C 1.519 -0.231 0 O-C-N 121.247 -0.908 . . . . 0.0 108.566 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.9 ptt-85 -60.74 -29.29 69.3 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.755 1.222 . . . . 0.0 113.611 -172.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -90.6 -42.85 10.55 Favored 'General case' 0 C--O 1.226 -0.17 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -59.04 -34.41 71.89 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.193 0.997 . . . . 0.0 112.776 -174.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -42.25 -58.29 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.532 1.133 . . . . 0.0 109.364 167.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -73.04 -33.3 65.63 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.456 0.702 . . . . 0.0 112.235 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -96.2 4.84 52.13 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -168.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -128.38 88.51 2.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -50.06 -42.9 50.77 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -167.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -30.35 64.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.554 -0.716 . . . . 0.0 111.121 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -79.95 -17.55 52.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.214 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -48.8 76.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 167.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.55 -34.95 62.69 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.216 1.406 . . . . 0.0 112.408 -169.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.06 -34.73 68.55 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.897 1.279 . . . . 0.0 111.525 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -54.71 43.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.492 1.117 . . . . 0.0 108.245 175.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -66.28 -37.7 86.08 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.482 1.113 . . . . 0.0 110.665 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -57.75 -36.75 72.53 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 117.913 -1.041 . . . . 0.0 112.098 172.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -68.56 -42.92 77.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.524 1.511 . . . . 0.0 110.629 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 m -73.01 -41.31 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 121.167 -0.958 . . . . 0.0 111.075 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.2 mmt -59.2 -41.86 89.52 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.38 0.672 . . . . 0.0 110.38 170.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.89 -42.95 98.99 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.576 0.625 . . . . 0.0 111.229 176.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -8.3 15.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.554 1.541 . . . . 0.0 112.031 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.53 -3.82 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.441 1.896 . . . . 0.0 109.566 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -56.71 -28.29 60.69 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -163.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.15 -15.09 59.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.474 1.034 . . . . 0.0 113.047 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -118.68 -31.45 4.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.592 1.157 . . . . 0.0 111.162 169.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.44 -26.65 61.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.078 -1.014 . . . . 0.0 111.316 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.87 -15.56 8.94 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.817 1.19 . . . . 0.0 113.703 175.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -122.59 13.91 10.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.542 1.137 . . . . 0.0 111.721 174.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.34 -1.7 8.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.79 1.236 . . . . 0.0 112.385 171.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.0 p -75.97 68.22 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 124.848 1.259 . . . . 0.0 110.091 167.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -152.96 27.63 0.53 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.162 0.985 . . . . 0.0 110.554 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.73 178.73 46.41 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.975 1.274 . . . . 0.0 110.579 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.45 174.15 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 124.113 3.209 . . . . 0.0 111.818 -178.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -128.37 152.58 48.01 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.873 1.269 . . . . 0.0 107.776 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -140.17 151.22 45.07 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.304 1.842 . . . . 0.0 106.939 -172.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -134.27 144.12 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.949 0.795 . . . . 0.0 109.046 -172.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -137.49 155.6 49.1 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.609 1.963 . . . . 0.0 107.066 164.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.9 p -147.92 156.48 9.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 120.435 -1.415 . . . . 0.0 110.036 -172.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.03 145.77 51.65 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 164.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.49 132.43 51.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.15 -177.56 3.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.931 2.493 . . . . 0.0 107.97 -170.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.87 -36.52 79.42 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -164.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 45.8 mmtm -141.63 27.79 1.84 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.405 1.082 . . . . 0.0 112.01 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.66 -171.99 40.08 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -174.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.86 144.51 41.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.897 1.279 . . . . 0.0 108.384 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -94.52 137.35 33.75 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 161.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -126.52 125.43 67.24 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 N-CA-C 104.993 -2.225 . . . . 0.0 104.993 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.5 142.71 18.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.47 147.13 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 118.475 0.579 . . . . 0.0 109.761 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.26 170.19 16.46 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.173 0.989 . . . . 0.0 110.01 -164.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 mttt . . . . . 0 C--N 1.344 0.329 0 C-N-CA 124.099 0.96 . . . . 0.0 111.225 171.227 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -124.55 75.71 1.43 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -155.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 mm -65.92 153.04 8.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 125.053 1.341 . . . . 0.0 110.106 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -141.11 151.41 43.92 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.02 1.728 . . . . 0.0 110.118 170.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -114.69 89.85 3.2 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.067 1.747 . . . . 0.0 106.502 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -59.49 -53.28 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 34.6 p-10 -154.13 -166.16 2.29 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.778 2.031 . . . . 0.0 106.413 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.33 0.34 25.88 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 120.937 -1.102 . . . . 0.0 113.337 -174.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -126.59 -53.82 1.45 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 124.337 1.055 . . . . 0.0 110.051 -169.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.1 m -80.48 135.88 36.21 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 169.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.3 m -128.9 156.75 41.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 163.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.5 pttt -136.13 170.98 15.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 168.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.32 150.95 32.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -101.29 145.81 28.37 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 164.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.2 ttt -141.29 105.45 4.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 124.488 1.115 . . . . 0.0 108.195 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -66.4 150.72 48.48 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.479 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.9 m-85 -53.01 -42.63 65.81 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.11 -9.39 84.0 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 119.804 -1.189 . . . . 0.0 113.488 -175.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -66.46 -45.14 80.73 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.796 1.798 . . . . 0.0 108.854 165.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 23.0 mt -65.34 -42.15 93.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 C-N-CA 124.959 1.304 . . . . 0.0 107.706 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -62.73 -38.84 92.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.412 0.551 . . . . 0.0 111.627 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.37 -42.56 83.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.376 0.67 . . . . 0.0 110.574 -177.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.4 mtt85 -67.09 -7.96 26.99 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.14 0.976 . . . . 0.0 112.019 170.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.66 8.37 86.12 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.075 0.845 . . . . 0.0 113.058 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -85.7 -171.11 3.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 168.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -143.2 153.96 43.37 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -62.29 -33.34 74.45 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -167.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.13 -43.27 13.19 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -57.46 -35.26 69.92 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.088 0.955 . . . . 0.0 112.749 -172.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -42.61 -56.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.33 1.052 . . . . 0.0 109.475 168.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -77.04 -14.87 59.77 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.274 1.03 . . . . 0.0 113.681 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -118.66 7.09 11.63 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.874 0.87 . . . . 0.0 112.429 -167.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -130.09 86.65 2.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -50.23 -40.07 46.41 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -165.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -30.73 59.92 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.719 -0.613 . . . . 0.0 111.324 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -79.78 -16.73 54.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.296 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.94 -48.19 79.99 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 168.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -54.8 -33.73 61.85 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.212 1.405 . . . . 0.0 112.457 -170.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.36 -35.34 71.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.679 1.192 . . . . 0.0 111.277 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -55.84 29.19 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.406 ' HA ' HG22 ' A' ' 44' ' ' VAL . 67.6 m-85 -63.9 -36.48 84.08 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.468 1.107 . . . . 0.0 110.518 -175.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 72.1 m95 -61.21 -40.02 92.41 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.272 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -69.37 -38.13 77.91 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.666 1.575 . . . . 0.0 111.099 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' A' ' 41' ' ' PHE . 18.6 m -74.15 -40.54 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 121.03 -1.044 . . . . 0.0 111.737 178.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.1 tpp -60.79 -39.51 89.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.02 172.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.63 -38.93 75.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.698 1.135 . . . . 0.0 111.638 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.3 -8.07 5.29 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.421 1.488 . . . . 0.0 113.478 174.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.0 t -129.58 -10.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 125.596 1.558 . . . . 0.0 110.879 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.98 -29.83 68.71 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -158.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.92 -16.72 45.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.766 0.712 . . . . 0.0 112.571 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -113.43 8.48 17.89 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.188 1.795 . . . . 0.0 110.893 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -131.4 -17.14 2.99 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 125.138 1.375 . . . . 0.0 111.896 -173.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.68 -16.87 18.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -108.73 5.93 25.2 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.953 1.701 . . . . 0.0 112.006 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.54 -3.89 2.96 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.515 1.526 . . . . 0.0 112.776 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.73 67.24 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 123.156 1.455 . . . . 0.0 110.125 169.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -161.33 39.09 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.612 1.565 . . . . 0.0 108.141 -171.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.68 -174.63 27.63 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 125.727 1.632 . . . . 0.0 110.245 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.27 174.34 9.23 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.7 2.933 . . . . 0.0 111.509 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.4 tp -145.66 147.76 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.868 1.267 . . . . 0.0 108.064 173.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -144.13 147.15 33.33 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.022 1.329 . . . . 0.0 107.807 -175.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.471 HG23 HG12 ' A' ' 75' ' ' VAL . 3.7 mm -139.56 140.86 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -173.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -144.26 169.52 17.73 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.621 1.168 . . . . 0.0 109.583 161.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.2 p -146.65 162.45 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.173 -0.955 . . . . 0.0 109.955 -169.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -133.86 148.07 51.24 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 126.685 1.994 . . . . 0.0 105.631 161.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.38 129.2 55.54 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 166.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -119.47 -177.55 3.4 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.557 2.343 . . . . 0.0 108.1 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.66 -35.95 79.43 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -165.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.479 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.2 mmtm -140.96 26.3 2.06 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.478 1.111 . . . . 0.0 112.073 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.26 -171.42 39.25 Favored Glycine 0 C--O 1.228 -0.22 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 -174.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -137.59 144.96 42.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 125.186 1.394 . . . . 0.0 108.111 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -96.43 140.39 31.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 161.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -126.76 128.08 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.57 134.45 60.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 104.078 -2.564 . . . . 0.0 104.078 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.471 HG12 HG23 ' A' ' 62' ' ' ILE . 3.1 m -131.68 135.04 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -127.56 159.46 34.55 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -161.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? . . . . . 0 C--O 1.235 0.329 0 C-N-CA 125.025 1.33 . . . . 0.0 108.047 172.622 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.398 0.142 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -138.12 117.52 12.85 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -162.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 mp -112.76 152.92 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 120.649 1.568 . . . . 0.0 108.223 -177.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -137.17 150.58 48.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.387 1.875 . . . . 0.0 109.239 172.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.25 106.3 15.67 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 173.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 38.4 mm -70.69 -54.77 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -179.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -159.11 -168.19 2.28 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.631 1.572 . . . . 0.0 108.665 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -60.29 -15.77 28.24 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.799 1.24 . . . . 0.0 113.475 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -125.57 -46.64 1.73 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.174 -0.953 . . . . 0.0 111.785 -168.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.3 m -87.45 141.5 28.58 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -128.66 157.57 41.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 164.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -133.81 166.57 22.36 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 164.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.462 ' CE1' HG21 ' A' ' 44' ' ' VAL . 46.7 p90 -151.96 170.8 18.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -132.77 136.39 46.3 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -129.76 114.36 15.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 -171.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.97 154.63 39.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.477 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.1 m-85 -55.48 -39.02 69.89 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.389 -0.819 . . . . 0.0 111.58 173.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.34 -25.7 72.52 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-O 119.119 -0.823 . . . . 0.0 113.126 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -37.23 81.69 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.402 1.601 . . . . 0.0 109.736 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 71.1 mt -73.74 -43.18 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.07 -39.95 87.82 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.809 1.244 . . . . 0.0 111.7 176.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.89 -42.36 99.75 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.698 0.799 . . . . 0.0 111.145 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.3 mtt85 -68.19 -12.17 60.5 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.37 173.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 12.57 84.05 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.799 1.19 . . . . 0.0 112.829 -177.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -82.02 -177.72 6.72 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 168.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.418 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 9.5 t70 -132.19 146.89 52.33 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 173.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -57.11 -30.37 64.32 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.366 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -82.85 -50.05 9.04 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.933 0.788 . . . . 0.0 109.169 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.1 mm-40 -55.9 -36.0 67.17 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.228 1.011 . . . . 0.0 112.671 -171.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.72 -56.55 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.587 1.155 . . . . 0.0 109.524 169.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -76.04 -13.78 60.22 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -118.38 7.75 12.02 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.585 0.754 . . . . 0.0 112.32 -167.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -137.62 88.25 2.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.04 -2.207 . . . . 0.0 105.04 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -49.85 -42.86 48.38 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -165.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 -32.25 65.59 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 121.594 -0.691 . . . . 0.0 111.016 -178.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -77.56 -18.84 56.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.072 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -55.44 24.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 165.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -52.14 -33.96 42.42 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.498 1.519 . . . . 0.0 113.171 -166.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.426 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 1.8 mm-40 -54.52 -40.59 68.75 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.47 1.108 . . . . 0.0 111.264 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.4 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -60.21 -51.29 70.22 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.173 0.989 . . . . 0.0 109.576 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -65.55 -34.61 78.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.019 0.927 . . . . 0.0 110.131 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -62.08 -36.58 82.1 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.613 -1.184 . . . . 0.0 112.446 172.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.36 -46.63 82.58 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 121.082 1.765 . . . . 0.0 110.856 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.51 -41.49 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 121.78 -0.575 . . . . 0.0 110.762 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 tpp -59.68 -41.86 91.64 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.451 0.7 . . . . 0.0 109.715 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -62.02 -42.16 98.87 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.411 -0.805 . . . . 0.0 111.37 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -64.6 -8.43 14.19 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 126.328 1.851 . . . . 0.0 112.211 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.9 m -125.92 4.08 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.761 1.224 . . . . 0.0 111.907 175.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.47 -25.48 66.06 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -163.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -61.46 -23.25 65.73 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.451 1.023 . . . . 0.0 111.78 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -90.89 -7.59 51.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.584 1.154 . . . . 0.0 111.492 177.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.57 -23.59 2.32 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -157.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.34 -27.27 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.52 1.055 . . . . 0.0 112.539 -176.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -79.45 -10.51 59.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.164 0.985 . . . . 0.0 112.376 176.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -131.97 -10.67 3.4 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.461 1.105 . . . . 0.0 113.82 -163.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.8 m -72.59 3.56 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.73 1.605 . . . . 0.0 113.714 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -58.01 -21.21 43.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.426 1.09 . . . . 0.0 113.302 156.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.76 -175.89 38.31 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.889 1.233 . . . . 0.0 112.191 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -72.53 171.24 17.53 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 112.154 -175.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 28.6 tp -142.26 152.11 42.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.506 1.522 . . . . 0.0 106.936 166.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -142.65 152.06 42.07 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.884 1.674 . . . . 0.0 107.087 -173.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mm -135.18 142.35 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -172.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -139.61 153.7 47.41 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.57 2.348 . . . . 0.0 106.36 170.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.7 p -139.81 160.95 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.048 -1.032 . . . . 0.0 109.217 -178.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -133.92 148.06 51.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 161.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.81 128.27 55.7 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.404 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -119.22 -175.06 2.85 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.482 2.313 . . . . 0.0 107.939 -169.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -62.92 -36.75 84.43 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -165.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -141.56 25.02 2.04 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.524 1.13 . . . . 0.0 112.4 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.63 -170.72 38.82 Favored Glycine 0 CA--C 1.518 0.27 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 mp -136.9 144.57 43.56 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.061 1.344 . . . . 0.0 108.368 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.404 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 32.2 mt-10 -93.04 145.87 24.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 160.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.71 129.81 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 176.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.58 137.63 49.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 104.03 -2.582 . . . . 0.0 104.03 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.82 134.78 55.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 119.249 0.931 . . . . 0.0 109.452 175.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.3 p -131.61 176.14 8.57 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.16 0.984 . . . . 0.0 110.391 -157.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 66.5 mttt . . . . . 0 N--CA 1.466 0.358 0 C-N-CA 125.645 1.578 . . . . 0.0 111.148 175.774 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -140.05 85.85 2.05 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -150.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 mm -72.35 152.11 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 124.003 0.921 . . . . 0.0 109.357 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -141.98 151.8 42.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.716 1.607 . . . . 0.0 110.178 170.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -113.73 102.43 10.24 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.7 mm -69.04 -53.69 24.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -159.73 -166.6 1.79 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.888 1.675 . . . . 0.0 108.694 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.73 -16.38 60.97 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -126.19 -26.53 3.36 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.643 1.177 . . . . 0.0 112.725 -164.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 73.4 m -115.21 134.76 54.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.553 1.141 . . . . 0.0 108.241 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.6 m -122.44 157.57 27.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 166.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -134.76 168.09 19.66 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 162.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.462 ' CE1' HG21 ' A' ' 44' ' ' VAL . 41.0 p90 -149.77 162.51 40.13 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -117.45 126.76 53.18 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 171.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.8 ttt -115.98 108.26 16.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 125.37 1.468 . . . . 0.0 108.02 -177.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.18 147.89 51.63 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.736 171.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -51.35 -39.33 56.83 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.27 -25.17 71.03 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 118.729 -1.04 . . . . 0.0 113.237 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -70.93 -38.58 72.92 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.773 1.787 . . . . 0.0 110.822 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.1 mt -64.47 -47.27 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -58.93 -43.49 91.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.349 1.459 . . . . 0.0 111.858 174.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.68 -44.98 94.86 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.928 0.891 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -68.62 -5.29 19.17 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.018 0.927 . . . . 0.0 111.733 172.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.75 12.47 84.47 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 124.502 1.049 . . . . 0.0 112.87 175.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -78.58 -175.08 4.15 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 163.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.428 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.1 t70 -133.42 144.08 49.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.6 ptt180 -55.36 -33.51 63.47 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.785 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.06 -49.43 15.35 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.778 0.717 . . . . 0.0 109.411 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.428 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.5 mm-40 -59.76 -34.92 73.61 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.973 0.909 . . . . 0.0 112.146 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -49.94 -52.0 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 123.521 0.729 . . . . 0.0 109.566 171.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -65.73 -36.97 85.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.045 0.839 . . . . 0.0 111.243 -177.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -101.29 1.65 38.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -160.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -135.65 91.46 2.71 Favored 'General case' 0 CA--C 1.524 -0.056 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -59.59 -50.78 72.54 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -160.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -31.52 64.72 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 174.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -80.55 -18.51 48.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.52 175.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.96 -52.16 64.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 165.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -52.18 -34.09 43.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.359 1.463 . . . . 0.0 113.098 -168.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -57.52 -37.47 73.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.356 1.063 . . . . 0.0 111.646 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -56.25 24.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.761 0.824 . . . . 0.0 108.92 176.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -62.14 -35.1 77.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.732 0.813 . . . . 0.0 109.888 -176.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 63.9 m95 -65.09 -34.81 79.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.787 -1.101 . . . . 0.0 112.907 171.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -35.62 71.43 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 121.099 1.772 . . . . 0.0 111.277 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.7 m -75.02 -36.8 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 121.118 -0.989 . . . . 0.0 111.779 176.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -46.0 80.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 118.986 -0.53 . . . . 0.0 110.255 165.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.67 -34.94 73.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.697 0.681 . . . . 0.0 112.316 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.47 -17.08 11.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 112.578 173.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 30.5 m -134.78 11.67 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.592 1.557 . . . . 0.0 112.46 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -26.65 39.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.526 1.131 . . . . 0.0 113.129 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.63 -22.36 66.36 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -104.6 -39.83 6.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.668 1.187 . . . . 0.0 110.165 173.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -65.71 -21.23 66.51 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.258 -0.877 . . . . 0.0 112.177 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -58.38 -19.98 40.28 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.912 1.687 . . . . 0.0 112.384 171.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -99.7 6.22 45.61 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.415 1.486 . . . . 0.0 111.291 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.82 -4.86 1.05 Allowed 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -173.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -88.12 1.05 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 121.314 1.87 . . . . 0.0 112.397 169.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -57.35 -12.75 2.69 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.217 1.007 . . . . 0.0 112.783 149.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -130.1 -178.21 15.29 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.994 1.759 . . . . 0.0 110.695 176.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.02 177.46 7.73 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.526 2.818 . . . . 0.0 113.172 -166.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.0 tp -141.42 149.63 41.29 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.417 1.487 . . . . 0.0 107.009 166.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -145.1 151.22 38.15 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.255 1.422 . . . . 0.0 107.582 -171.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.6 mm -133.26 144.07 37.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -170.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -140.58 149.94 43.01 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.827 1.651 . . . . 0.0 107.135 163.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.6 155.92 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 120.755 -1.216 . . . . 0.0 110.143 -173.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.71 150.47 36.33 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 161.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.92 148.62 26.14 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 167.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mp -128.89 -177.06 4.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.354 2.662 . . . . 0.0 108.319 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.6 -32.52 73.55 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -169.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.448 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.1 mmtm -138.33 19.39 2.76 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.324 1.049 . . . . 0.0 112.663 -176.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 177.5 -164.98 34.46 Favored Glycine 0 C--O 1.225 -0.422 0 O-C-N 121.119 -0.988 . . . . 0.0 111.144 -175.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.5 mp -131.42 145.87 52.0 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.748 1.619 . . . . 0.0 107.264 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -103.19 130.83 50.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 160.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -118.38 128.09 75.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 105.032 -2.211 . . . . 0.0 105.032 178.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -104.41 144.51 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 168.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.87 127.64 40.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -176.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -131.74 170.59 14.6 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 118.902 0.774 . . . . 0.0 111.535 -163.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.5 mttm . . . . . 0 C--O 1.233 0.222 0 C-N-CA 124.991 1.317 . . . . 0.0 109.545 163.009 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 ptm . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.61 72.84 1.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.035 1.334 . . . . 0.0 107.959 -166.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 mm -62.03 151.88 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 124.923 1.289 . . . . 0.0 109.468 175.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -147.67 127.24 13.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.855 1.262 . . . . 0.0 110.147 172.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -82.22 110.38 17.36 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.467 HD11 ' HG2' ' A' ' 12' ' ' LYS . 21.0 mm -74.53 -55.71 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -156.86 -165.19 1.79 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.406 1.483 . . . . 0.0 108.643 -177.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.68 -20.86 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.14 0.976 . . . . 0.0 113.474 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -124.67 -42.3 2.08 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.966 0.906 . . . . 0.0 111.613 -166.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 55.6 m -92.2 137.85 32.02 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 m -127.07 155.77 38.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 166.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.467 ' HG2' HD11 ' A' ' 6' ' ' ILE . 42.6 pttt -129.73 171.57 12.53 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 165.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -151.42 152.42 33.04 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -105.56 142.51 35.18 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 166.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.9 ttt -138.24 104.75 5.28 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 125.017 1.327 . . . . 0.0 108.063 -172.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -67.06 154.07 42.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -51.61 -33.35 32.6 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.23 -11.2 76.26 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 119.897 -1.144 . . . . 0.0 113.41 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -68.69 -40.54 80.03 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.702 1.751 . . . . 0.0 108.846 166.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.4 mt -64.12 -46.38 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.162 1.385 . . . . 0.0 108.698 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.71 -35.3 80.36 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.47 0.308 . . . . 0.0 111.346 -177.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.33 -43.38 98.95 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.362 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.1 mtt-85 -69.35 -7.08 34.15 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.355 1.062 . . . . 0.0 111.455 174.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.62 84.6 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.412 1.006 . . . . 0.0 112.731 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -83.89 -175.13 5.66 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -141.56 148.7 39.73 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -57.01 -36.64 70.66 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.142 0.883 . . . . 0.0 111.397 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -76.06 -45.06 36.1 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.05 -37.06 81.27 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.256 -0.902 . . . . 0.0 111.866 -173.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -54.71 -44.81 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 124.146 0.978 . . . . 0.0 110.126 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -69.79 -26.48 64.29 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -120.98 8.73 10.47 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -157.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -131.48 100.59 5.2 Favored 'General case' 0 N--CA 1.458 -0.057 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -58.18 -16.69 14.48 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -165.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.34 -31.09 6.69 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.53 1.532 . . . . 0.0 111.777 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -77.71 -18.0 57.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.232 0.924 . . . . 0.0 111.124 176.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.3 p -54.39 -55.18 31.24 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.932 0.893 . . . . 0.0 109.329 165.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -56.89 -31.3 64.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.376 1.87 . . . . 0.0 112.865 -169.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -58.94 -36.13 74.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.453 1.101 . . . . 0.0 111.109 -177.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -55.69 29.04 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -62.82 -36.1 82.09 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.095 0.958 . . . . 0.0 109.809 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -62.15 -38.81 90.4 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.765 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.66 -34.74 77.54 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.39 1.45 . . . . 0.0 110.698 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.8 m -77.59 -39.44 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 120.921 -1.112 . . . . 0.0 111.795 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -42.6 77.03 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.846 -0.533 . . . . 0.0 110.098 169.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.44 -40.18 85.96 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.051 0.541 . . . . 0.0 111.849 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -60.8 -11.23 7.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.903 1.281 . . . . 0.0 112.936 173.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -123.04 5.11 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.304 1.842 . . . . 0.0 109.571 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -57.14 -31.9 65.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.245 -1.534 . . . . 0.0 114.031 -166.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.15 -12.75 42.88 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -114.95 -37.28 4.2 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.765 1.626 . . . . 0.0 110.318 175.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -58.66 -29.32 66.49 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.491 -0.755 . . . . 0.0 110.948 174.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -59.18 -13.29 6.92 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.112 1.324 . . . . 0.0 113.863 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -124.86 14.85 8.6 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.665 1.186 . . . . 0.0 111.829 173.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -128.76 -4.16 5.23 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.696 1.198 . . . . 0.0 112.973 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.4 p -78.83 62.11 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 123.362 1.553 . . . . 0.0 110.858 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -159.48 32.37 0.2 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.8 1.24 . . . . 0.0 109.314 -168.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.48 -177.16 38.22 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.753 1.644 . . . . 0.0 109.795 -177.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.6 170.89 16.5 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.294 2.663 . . . . 0.0 111.377 -179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.39 148.41 46.18 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -138.24 148.52 44.83 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.6 mm -139.34 141.41 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -143.78 161.78 37.74 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.664 0.786 . . . . 0.0 109.461 156.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.4 p -152.23 157.76 4.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 O-C-N 121.203 -0.936 . . . . 0.0 109.868 -171.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -144.74 149.56 35.75 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 162.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.41 146.97 32.52 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 165.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.07 -179.18 4.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.103 2.561 . . . . 0.0 108.163 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -62.08 -31.06 71.46 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -166.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.3 mmtm -140.39 22.0 2.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.25 1.02 . . . . 0.0 112.197 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.92 -168.79 37.99 Favored Glycine 0 CA--C 1.519 0.323 0 O-C-N 121.059 -1.026 . . . . 0.0 111.275 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.0 mp -132.38 146.38 51.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 125.793 1.637 . . . . 0.0 107.703 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.81 131.29 52.47 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 160.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -116.15 135.07 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.819 -2.289 . . . . 0.0 104.819 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -111.82 141.96 25.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 165.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.92 144.06 37.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.49 161.71 34.28 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -161.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.3 mppt? . . . . . 0 CA--C 1.534 0.332 0 C-N-CA 125.973 1.709 . . . . 0.0 108.027 174.281 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -143.08 128.01 18.39 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 -150.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.47 150.49 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 120.285 1.402 . . . . 0.0 108.675 -168.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.9 151.51 42.72 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.012 1.325 . . . . 0.0 110.032 174.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.91 103.58 11.08 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.8 mm -69.72 -55.14 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -157.18 -171.41 3.61 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.038 1.735 . . . . 0.0 108.058 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.07 -13.14 14.83 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.56 1.144 . . . . 0.0 113.593 -175.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -123.04 -52.25 1.87 Allowed 'General case' 0 C--N 1.342 0.252 0 O-C-N 121.048 -1.033 . . . . 0.0 110.851 -171.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.0 m -80.93 141.36 34.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -128.81 158.77 41.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.1 pttt -134.84 164.07 28.39 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 164.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -149.85 165.47 32.44 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -124.78 136.62 54.01 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 172.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.3 ttt -133.21 116.34 16.09 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.7 m -76.61 156.57 32.62 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.452 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.4 m-85 -55.5 -43.61 75.82 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.207 -0.933 . . . . 0.0 111.908 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.38 -9.85 86.59 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-O 118.587 -1.118 . . . . 0.0 113.451 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -66.02 -36.22 82.67 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.883 1.841 . . . . 0.0 109.062 166.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.94 -41.03 31.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.151 1.38 . . . . 0.0 107.672 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.88 -37.9 83.78 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.349 0.522 . . . . 0.0 111.502 174.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.67 -42.14 91.68 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.878 0.847 . . . . 0.0 110.895 -177.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.7 mtt85 -68.47 -8.99 45.82 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.382 172.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.95 12.98 83.87 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.457 1.027 . . . . 0.0 112.866 177.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.56 -170.74 3.26 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 165.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -142.37 150.92 41.34 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 172.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -60.94 -32.4 71.92 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -169.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -84.84 -42.65 14.89 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -57.86 -36.09 71.85 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 124.092 0.957 . . . . 0.0 112.419 -173.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.2 mm -44.15 -51.55 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.703 1.201 . . . . 0.0 110.586 169.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -78.43 -14.28 59.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.75 7.82 9.96 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -166.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -125.32 99.1 5.91 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.552 1.541 . . . . 0.0 106.958 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -54.82 -20.57 8.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.732 1.613 . . . . 0.0 115.068 -169.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.87 -30.62 9.26 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.963 0.801 . . . . 0.0 112.02 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -78.49 -16.7 57.24 Favored 'General case' 0 C--N 1.338 0.079 0 CA-C-N 118.92 0.782 . . . . 0.0 111.281 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 12.9 p -54.06 -58.56 6.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 166.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.39 -31.42 63.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.438 1.895 . . . . 0.0 112.486 -166.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 2.9 mm-40 -59.89 -35.22 74.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 111.307 -176.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -56.86 16.28 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 122.301 1.048 . . . . 0.0 108.548 175.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.25 -37.91 89.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.451 1.1 . . . . 0.0 110.395 -174.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -58.63 -37.0 74.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.969 172.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.52 -43.44 76.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.347 1.431 . . . . 0.0 110.388 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.8 m -71.13 -40.89 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.935 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.7 mmt -58.53 -43.28 89.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 122.802 0.441 . . . . 0.0 110.647 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -60.27 -42.09 94.64 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.584 0.629 . . . . 0.0 111.256 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -64.21 -6.0 5.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.37 1.868 . . . . 0.0 112.161 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -126.77 -0.89 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.635 1.974 . . . . 0.0 109.571 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -57.31 -28.83 63.41 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -161.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.13 -22.26 60.59 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.055 0.843 . . . . 0.0 112.415 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -100.43 -0.91 37.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.065 1.346 . . . . 0.0 111.616 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.12 -20.37 3.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.276 1.03 . . . . 0.0 111.801 -163.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -59.71 -14.48 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.942 1.297 . . . . 0.0 114.316 -174.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -126.01 18.31 7.82 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.522 1.529 . . . . 0.0 110.486 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.24 27.74 1.56 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.143 1.377 . . . . 0.0 112.061 -174.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.28 48.52 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 123.098 1.428 . . . . 0.0 107.716 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -122.35 35.48 4.87 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.469 2.308 . . . . 0.0 108.053 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.77 -177.24 37.2 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 126.418 1.961 . . . . 0.0 109.441 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -69.88 170.93 15.56 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.501 2.8 . . . . 0.0 111.943 -176.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.42 152.37 48.31 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 172.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -148.62 145.04 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.367 1.467 . . . . 0.0 107.185 -163.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.7 mm -135.33 145.41 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -133.21 148.51 52.03 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 158.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.3 p -136.22 157.77 37.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 171.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.487 HE22 HD13 ' A' ' 74' ' ' ILE . 1.2 pm0 -146.25 151.57 37.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 159.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.01 143.54 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.402 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -125.78 -171.87 2.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.215 2.606 . . . . 0.0 107.691 -173.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.11 -37.96 84.61 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -166.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.452 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.3 mmtm -141.78 27.45 1.83 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.363 1.065 . . . . 0.0 112.379 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.74 -169.07 38.92 Favored Glycine 0 C--O 1.23 -0.139 0 O-C-N 120.929 -1.107 . . . . 0.0 110.478 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mp -135.26 144.35 46.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.222 1.009 . . . . 0.0 109.236 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.402 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.8 mt-10 -93.2 133.93 35.9 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.53 132.1 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.487 HD13 HE22 ' A' ' 65' ' ' GLN . 1.4 mp -112.24 143.31 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 170.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.52 136.33 52.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 118.839 0.745 . . . . 0.0 109.365 171.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -129.69 174.98 9.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.182 0.993 . . . . 0.0 110.146 -160.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 75.7 mttt . . . . . 0 N--CA 1.465 0.283 0 C-N-CA 125.239 1.416 . . . . 0.0 110.721 172.128 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptm . . . . . 0 N--CA 1.496 1.839 0 N-CA-C 111.402 0.149 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -134.75 130.71 36.62 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.0 mm -122.31 152.24 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 125.057 1.343 . . . . 0.0 108.907 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.01 152.18 46.05 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.12 1.368 . . . . 0.0 110.121 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -119.59 92.61 3.83 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.038 1.735 . . . . 0.0 106.461 177.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.9 -53.51 40.8 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 38.9 p30 -157.28 -162.98 1.29 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.006 1.722 . . . . 0.0 108.24 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -67.48 -17.12 64.57 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -123.81 -50.26 1.84 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.411 -0.805 . . . . 0.0 110.852 -164.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 27.8 m -81.42 133.07 35.36 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 170.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -128.94 159.9 40.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 163.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.4 pttt -139.13 167.14 22.73 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 164.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 44' ' ' VAL . 53.8 p90 -148.95 166.69 27.86 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -125.38 133.99 52.33 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 106.128 -1.805 . . . . 0.0 106.128 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.4 tpt -129.42 107.23 9.34 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -169.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.67 154.62 41.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 174.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.9 m-85 -53.52 -37.91 63.26 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.707 -0.621 . . . . 0.0 111.893 175.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.54 -26.08 74.85 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 119.018 -0.879 . . . . 0.0 113.304 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.81 -30.66 69.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.692 1.746 . . . . 0.0 110.316 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 78.0 mt -77.97 -44.62 28.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -58.9 -39.82 82.62 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 124.835 1.254 . . . . 0.0 111.631 175.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.98 -44.16 97.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.96 0.886 . . . . 0.0 111.257 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 79.3 mtt85 -72.09 -5.6 36.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.677 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 11.64 85.02 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.719 1.152 . . . . 0.0 112.903 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -85.05 -175.09 5.61 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 168.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -135.33 146.54 48.54 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 173.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -52.86 -35.28 57.4 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.991 0.814 . . . . 0.0 111.119 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -80.39 -45.11 18.25 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.537 1.135 . . . . 0.0 108.967 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -61.18 -36.09 78.89 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.213 1.005 . . . . 0.0 112.319 -176.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.88 -49.87 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.1 m95 -84.21 -26.4 28.76 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -97.39 -17.08 19.92 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 122.937 0.495 . . . . 0.0 111.316 -167.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.8 -171.48 3.54 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 158.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -135.98 -48.01 0.67 Allowed 'General case' 0 N--CA 1.476 0.849 0 O-C-N 121.186 -0.946 . . . . 0.0 111.136 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.28 -34.64 76.54 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.369 0.668 . . . . 0.0 110.605 175.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -79.84 -12.54 59.75 Favored 'General case' 0 C--N 1.34 0.182 0 O-C-N 121.49 -0.756 . . . . 0.0 111.925 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.71 -41.5 75.26 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 168.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.603 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 15.7 tt0 -56.28 -30.98 63.19 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 125.128 1.371 . . . . 0.0 113.013 -171.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.76 -33.5 75.79 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.653 1.981 . . . . 0.0 111.033 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -44.88 92.24 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.603 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -71.12 -40.68 71.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.652 0.781 . . . . 0.0 108.958 -173.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -56.45 -40.44 74.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.369 171.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.05 -22.26 65.6 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.396 0.998 . . . . 0.0 113.08 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -103.99 -38.09 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 119.846 1.203 . . . . 0.0 111.853 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -43.27 64.68 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 163.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.86 -44.64 66.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 123.779 0.832 . . . . 0.0 112.441 173.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -62.62 -7.37 4.64 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 t -129.02 -2.95 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 126.059 1.744 . . . . 0.0 110.003 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -59.99 -29.88 68.75 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.515 -1.365 . . . . 0.0 114.517 -159.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.84 -11.69 40.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.413 0.685 . . . . 0.0 112.46 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -113.82 -31.73 6.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.229 1.812 . . . . 0.0 110.623 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.26 -28.27 67.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.415 1.007 . . . . 0.0 111.009 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.28 -22.31 40.7 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.139 0.881 . . . . 0.0 112.747 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -83.75 -10.65 57.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.904 0.775 . . . . 0.0 112.335 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -138.15 4.83 2.5 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.294 1.038 . . . . 0.0 113.581 -165.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.59 77.6 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-O 122.801 1.286 . . . . 0.0 109.033 174.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -147.82 22.88 1.11 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.918 1.287 . . . . 0.0 110.827 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.25 176.89 42.59 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.796 1.189 . . . . 0.0 110.435 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.74 164.69 33.12 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.798 2.999 . . . . 0.0 112.03 -174.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.1 mt -87.53 158.93 18.8 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 164.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.5 m95 -143.18 141.75 31.23 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -133.57 143.17 39.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.386 0.994 . . . . 0.0 108.727 -172.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -137.38 155.66 49.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.147 1.379 . . . . 0.0 107.718 165.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.91 160.21 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 O-C-N 120.744 -1.222 . . . . 0.0 110.178 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.505 HE22 HD11 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -141.05 152.15 44.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 157.215 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.0 143.59 30.95 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.131 0.573 . . . . 0.0 109.618 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -125.93 -175.6 3.4 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.255 2.622 . . . . 0.0 107.599 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.9 -35.54 80.38 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -164.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.6 mmtm -141.07 25.54 2.09 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 112.14 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.91 -173.45 42.49 Favored Glycine 0 C--O 1.228 -0.27 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -175.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.52 144.86 46.54 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.478 1.111 . . . . 0.0 108.82 177.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -94.54 129.49 41.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 161.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.95 127.24 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.505 HD11 HE22 ' A' ' 65' ' ' GLN . 4.3 mp -95.8 147.09 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 166.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.97 139.99 50.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 172.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -134.94 168.47 19.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.097 0.959 . . . . 0.0 108.622 -173.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.9 mppt? -144.68 151.51 39.04 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.505 1.122 . . . . 0.0 109.903 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.74 -24.16 66.9 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.777 0.831 . . . . 0.0 112.783 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -57.57 -23.68 51.98 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.773 0.829 . . . . 0.0 112.169 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.0 tp -50.26 -29.37 9.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.93 172.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.5 m -129.75 32.9 4.52 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.011 1.324 . . . . 0.0 110.492 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -60.7 -46.81 88.96 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.562 -0.711 . . . . 0.0 109.486 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -75.42 123.08 24.79 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 163.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 tp -159.68 -44.39 0.05 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.607 0.763 . . . . 0.0 110.53 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -59.86 -26.71 66.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -173.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -68.05 -23.58 64.98 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -76.67 140.49 40.93 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 119.123 0.874 . . . . 0.0 108.723 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.4 158.95 62.55 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 125.296 1.438 . . . . 0.0 108.125 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -84.51 30.63 0.51 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 124.296 3.331 . . . . 0.0 112.601 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.614 1.966 . . . . 0.0 108.213 -172.848 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 120.737 0.303 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -124.98 77.95 1.66 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -160.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 mm -68.43 150.45 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.763 1.225 . . . . 0.0 109.327 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -151.66 102.25 2.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.355 1.062 . . . . 0.0 110.226 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -72.78 118.38 15.65 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.267 -1.521 . . . . 0.0 106.907 171.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 32.9 mm -81.92 -53.54 11.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 47.7 p30 -163.62 -175.14 4.01 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.894 1.677 . . . . 0.0 108.873 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.08 -14.99 1.81 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.366 1.467 . . . . 0.0 114.931 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -119.19 -27.26 5.71 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.265 1.426 . . . . 0.0 112.802 -167.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -129.81 140.79 50.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.457 1.103 . . . . 0.0 109.27 -172.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.8 m -130.07 153.64 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 106.219 -1.771 . . . . 0.0 106.219 166.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -132.29 168.31 18.31 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 168.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.521 ' CE1' HG21 ' A' ' 44' ' ' VAL . 40.8 p90 -155.0 165.17 37.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -118.69 140.91 49.17 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -132.38 112.13 11.91 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.9 m -73.19 156.97 38.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.1 m-85 -52.06 -43.44 63.81 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 121.985 -0.447 . . . . 0.0 111.745 173.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -78.81 -12.07 84.57 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 119.707 -1.235 . . . . 0.0 113.817 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -34.39 75.54 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.688 1.744 . . . . 0.0 109.422 165.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.15 -42.11 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -61.33 -37.54 83.65 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.735 0.698 . . . . 0.0 111.515 175.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.47 -42.51 98.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.838 0.828 . . . . 0.0 110.898 -176.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -72.39 -4.83 32.44 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.564 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.62 11.19 85.52 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.479 1.038 . . . . 0.0 113.071 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -82.86 -173.13 4.5 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 168.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -138.53 147.05 42.67 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 174.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.6 ptt85 -56.93 -35.5 69.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.676 0.671 . . . . 0.0 111.597 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.62 -45.52 29.8 Favored 'General case' 0 C--O 1.226 -0.147 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.97 -37.02 78.39 Favored 'General case' 0 C--N 1.332 -0.159 0 O-C-N 121.429 -0.795 . . . . 0.0 111.838 -172.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -53.32 -47.43 57.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.58 0.752 . . . . 0.0 109.947 171.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 m95 -68.64 -21.71 64.45 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.266 0.939 . . . . 0.0 112.943 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -120.56 4.06 10.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -161.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -137.87 83.56 1.99 Allowed 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -47.43 -42.77 23.06 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.58 -32.09 63.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.479 -0.763 . . . . 0.0 111.288 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -77.82 -19.66 54.57 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.59 -0.719 . . . . 0.0 110.95 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -51.96 64.89 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 166.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -52.42 -34.37 48.1 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.229 1.412 . . . . 0.0 113.228 -169.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.4 -36.56 69.06 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.797 1.239 . . . . 0.0 111.646 -179.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -53.06 62.63 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 124.093 0.957 . . . . 0.0 109.069 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -66.36 -32.42 73.8 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.398 1.079 . . . . 0.0 110.66 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.1 m95 -65.26 -44.43 88.12 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 118.347 -0.835 . . . . 0.0 111.889 170.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.94 -41.56 95.41 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.079 1.309 . . . . 0.0 110.878 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.521 HG21 ' CE1' ' A' ' 13' ' ' PHE . 27.9 m -68.96 -44.01 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 O-C-N 121.251 -0.906 . . . . 0.0 112.147 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 43.9 tpp -59.35 -39.56 83.63 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.03 -38.33 88.29 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.529 -0.732 . . . . 0.0 111.894 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.16 -13.8 41.38 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.52 1.528 . . . . 0.0 113.221 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 33.6 m -123.33 -5.34 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.361 1.064 . . . . 0.0 111.939 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -18.15 12.08 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -66.1 -16.9 64.34 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 120.277 1.399 . . . . 0.0 112.437 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -113.63 -36.88 4.76 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.483 0.713 . . . . 0.0 110.87 162.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -68.1 -13.07 61.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 118.003 -0.999 . . . . 0.0 112.473 -175.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -57.13 -27.41 61.82 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.486 1.494 . . . . 0.0 112.029 168.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -79.42 -5.87 55.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.285 0.634 . . . . 0.0 111.998 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.02 36.96 1.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.641 1.176 . . . . 0.0 111.205 -166.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.8 p -117.47 66.04 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 123.628 1.68 . . . . 0.0 106.577 171.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -153.18 36.41 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 113.942 -1.481 . . . . 0.0 109.251 -168.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.45 -176.25 39.21 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 126.087 1.803 . . . . 0.0 109.753 -173.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.45 170.07 12.95 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.459 2.773 . . . . 0.0 110.905 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.46 HD23 ' H ' ' A' ' 61' ' ' TRP . 0.5 OUTLIER -137.36 147.57 45.61 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.331 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.46 ' H ' HD23 ' A' ' 60' ' ' LEU . 90.4 m95 -143.74 144.19 31.72 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.557 1.543 . . . . 0.0 107.281 -164.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.454 HG23 HG12 ' A' ' 75' ' ' VAL . 3.8 mm -137.19 138.1 45.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -170.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -136.28 147.66 47.6 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.441 1.896 . . . . 0.0 107.641 169.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.37 154.74 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 O-C-N 120.975 -1.078 . . . . 0.0 109.671 -174.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -144.85 150.22 36.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 161.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.68 146.94 26.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 169.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.67 179.81 5.33 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 127.976 2.51 . . . . 0.0 108.315 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -58.39 -36.48 73.62 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -168.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.506 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 34.0 mmtp -139.16 27.14 2.37 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.119 0.967 . . . . 0.0 112.329 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.08 -168.32 37.38 Favored Glycine 0 CA--C 1.521 0.409 0 O-C-N 121.005 -1.059 . . . . 0.0 111.692 -174.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -133.0 145.19 50.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.112 1.765 . . . . 0.0 107.516 176.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -103.09 136.52 42.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 159.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.443 HD13 ' CE2' ' A' ' 13' ' ' PHE . 1.0 OUTLIER -123.58 131.38 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 178.767 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -111.84 136.51 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 168.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.454 HG12 HG23 ' A' ' 62' ' ' ILE . 4.2 m -131.08 141.94 44.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 119.569 1.077 . . . . 0.0 108.696 172.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.2 p -134.38 162.91 30.89 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -161.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 162.67 36.03 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.28 1.832 . . . . 0.0 107.492 174.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.98 146.67 46.13 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -70.73 170.16 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.126 0.57 . . . . 0.0 109.967 171.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 56.3 tp -136.71 152.88 50.87 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 171.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 p -61.97 -10.56 10.02 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -169.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -53.92 -47.51 71.13 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.265 0.939 . . . . 0.0 109.29 165.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -82.74 45.45 0.99 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.189 1.795 . . . . 0.0 110.335 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.7 tt -148.64 -55.19 0.2 Allowed 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 174.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -69.49 -40.06 77.25 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 122.357 0.263 . . . . 0.0 111.289 177.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -124.17 175.6 6.92 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.898 2.079 . . . . 0.0 109.802 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 69.9 mt -77.83 168.79 19.37 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 156.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 158.76 74.77 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 123.906 0.882 . . . . 0.0 109.228 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.66 149.45 32.07 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.777 2.985 . . . . 0.0 113.743 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 . . . . . 0 C--O 1.253 1.261 0 CA-C-N 114.572 -1.195 . . . . 0.0 108.57 163.458 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ptm . . . . . 0 N--CA 1.495 1.805 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.81 76.93 1.24 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.155 1.382 . . . . 0.0 107.794 -161.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -66.83 153.01 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 124.523 1.129 . . . . 0.0 109.599 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -146.76 138.17 24.3 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.972 1.309 . . . . 0.0 109.413 168.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mmt85 -89.85 126.45 35.71 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.98 -1.075 . . . . 0.0 108.142 166.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.453 HD11 ' HG2' ' A' ' 12' ' ' LYS . 24.1 mm -83.01 -61.94 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 172.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -153.55 17.7 0.53 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 111.526 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 74.16 -34.63 0.28 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 128.074 2.549 . . . . 0.0 113.603 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -68.56 -38.48 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.428 1.013 . . . . 0.0 108.859 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 57.1 m -110.12 140.4 44.24 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 125.642 1.577 . . . . 0.0 107.484 168.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 m -129.1 162.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 166.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HG2' HD11 ' A' ' 6' ' ' ILE . 49.9 pttt -135.39 172.74 12.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.763 -1.211 . . . . 0.0 109.683 165.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -144.8 160.55 41.08 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 168.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -118.27 149.5 41.02 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 162.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 4.8 ttt -144.64 103.41 3.93 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 -168.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.8 m -67.48 153.19 44.27 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.9 m-85 -53.12 -31.63 43.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.81 -25.51 73.06 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-O 119.066 -0.852 . . . . 0.0 113.663 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -69.86 -37.0 75.98 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.757 1.779 . . . . 0.0 109.739 174.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 11.3 mt -68.49 -44.71 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.405 1.482 . . . . 0.0 109.178 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -58.46 -38.92 78.55 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.587 1.155 . . . . 0.0 111.439 174.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.66 -40.7 97.86 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.518 0.675 . . . . 0.0 111.69 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtt-85 -68.51 -11.84 60.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.016 1.327 . . . . 0.0 111.27 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.51 3.19 78.36 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.61 1.576 . . . . 0.0 112.179 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.404 ' CE2' ' HG2' ' A' ' 39' ' ' GLU . 24.7 m-85 -90.19 -178.41 5.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.788 1.235 . . . . 0.0 110.081 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -137.89 153.33 49.55 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -60.65 -31.92 71.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.467 -170.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -81.79 -46.26 14.44 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 172.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -56.83 -35.73 69.16 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.0 0.92 . . . . 0.0 112.751 -171.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.1 mm -44.39 -53.49 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.604 1.162 . . . . 0.0 109.339 170.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 50.1 m95 -75.01 -17.07 60.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -115.33 8.95 15.53 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.328 0.651 . . . . 0.0 112.334 -165.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -142.03 92.42 2.44 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -50.86 -46.97 60.51 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.556 1.071 . . . . 0.0 112.655 -166.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.01 -21.52 65.94 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.565 -0.71 . . . . 0.0 111.515 -176.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -98.67 -5.63 31.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.062 1.345 . . . . 0.0 111.632 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.92 -49.85 14.63 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -55.78 -32.74 63.74 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.538 1.135 . . . . 0.0 112.921 -170.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.404 ' HG2' ' CE2' ' A' ' 25' ' ' PHE . 3.1 pp20? -53.15 -37.13 61.59 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.798 0.839 . . . . 0.0 111.848 174.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -59.07 6.0 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.412 ' HA ' HG22 ' A' ' 44' ' ' VAL . 76.9 m-85 -64.24 -40.02 95.16 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.073 1.349 . . . . 0.0 110.335 -173.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -61.13 -36.92 81.03 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 117.729 -1.129 . . . . 0.0 112.434 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -72.42 -37.18 68.7 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.669 1.577 . . . . 0.0 111.549 178.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 41' ' ' PHE . 17.6 m -70.47 -41.45 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 120.006 1.276 . . . . 0.0 111.152 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -42.08 87.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.934 -0.479 . . . . 0.0 110.445 170.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -58.06 -40.89 82.11 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 122.757 0.423 . . . . 0.0 111.269 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.57 -5.25 2.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.927 1.691 . . . . 0.0 112.78 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.5 t -131.94 2.76 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 126.404 1.881 . . . . 0.0 109.895 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -55.76 -37.47 68.57 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.162 -1.587 . . . . 0.0 113.985 -162.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.38 -8.76 27.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -119.06 -36.13 3.47 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.787 2.035 . . . . 0.0 109.901 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -57.17 -31.85 65.82 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.931 0.892 . . . . 0.0 110.984 170.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -57.39 -21.98 39.83 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.68 1.127 . . . . 0.0 112.854 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -83.97 -14.23 51.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.893 0.77 . . . . 0.0 112.381 176.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.95 -0.42 3.1 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -165.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.1 p -76.57 69.27 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 122.994 1.378 . . . . 0.0 110.404 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -155.73 27.73 0.38 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.062 1.345 . . . . 0.0 110.195 -173.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.44 -178.82 38.82 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.021 1.296 . . . . 0.0 110.557 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.9 169.49 18.97 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.762 2.975 . . . . 0.0 111.962 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.4 tp -129.72 148.15 51.57 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.48 1.512 . . . . 0.0 107.12 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -140.02 146.87 39.58 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -170.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -135.52 142.76 38.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -140.13 91.21 2.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.95 1.3 . . . . 0.0 108.196 165.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.82 154.59 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.521 0.728 . . . . 0.0 109.078 166.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.0 152.05 32.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 152.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.57 143.29 32.93 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 123.612 0.765 . . . . 0.0 109.883 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.475 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.7 mp -129.46 -176.03 3.77 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.968 2.507 . . . . 0.0 108.306 -172.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.04 -34.77 76.87 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -140.42 21.69 2.38 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.303 1.041 . . . . 0.0 112.355 -177.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.9 -170.15 40.48 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mp -134.74 142.62 46.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.863 1.265 . . . . 0.0 109.262 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.475 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 20.8 mt-10 -94.57 143.5 26.37 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 162.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.93 123.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.4 mp -92.42 145.64 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 104.675 -2.343 . . . . 0.0 104.675 167.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.65 131.73 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.84 159.41 39.89 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -165.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 mppt? -145.55 165.66 27.99 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 126.97 2.108 . . . . 0.0 108.39 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.25 160.66 10.13 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 164.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -59.43 146.24 40.82 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.828 0.451 . . . . 0.0 110.375 173.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.6 -32.82 74.63 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.027 0.531 . . . . 0.0 110.627 175.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 p -73.87 42.4 0.14 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.532 1.933 . . . . 0.0 111.782 172.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -54.89 -32.37 60.86 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.32 1.448 . . . . 0.0 110.907 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -139.69 176.18 8.95 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 155.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 57.9 tp -152.72 -42.01 0.1 Allowed 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.583 1.153 . . . . 0.0 110.085 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.86 -33.65 76.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.367 0.53 . . . . 0.0 111.482 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -95.33 36.67 1.22 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.0 0.92 . . . . 0.0 111.1 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 159.5 2.45 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 122.747 0.419 . . . . 0.0 111.584 169.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 m -139.79 160.29 61.54 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 125.227 1.411 . . . . 0.0 108.783 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -54.82 156.72 14.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.933 3.089 . . . . 0.0 113.264 174.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 93.4 mtt-85 . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.471 -0.776 . . . . 0.0 108.974 169.789 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.797 0.332 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -127.4 78.09 1.79 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -151.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 mp -76.8 153.71 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.494 1.118 . . . . 0.0 109.772 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -134.69 156.14 49.31 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.312 2.245 . . . . 0.0 108.154 170.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -124.29 89.34 3.06 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 105.998 -1.852 . . . . 0.0 105.998 176.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.0 -52.83 56.55 Favored 'Isoleucine or valine' 0 C--N 1.345 0.399 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -157.14 -164.1 1.53 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.189 1.796 . . . . 0.0 107.206 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -72.49 -9.93 59.17 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -176.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -126.6 -40.63 1.91 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.042 -1.036 . . . . 0.0 112.184 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 56.8 m -92.86 134.53 34.99 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 165.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 m -128.88 156.55 41.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 105.259 -2.126 . . . . 0.0 105.259 165.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -142.13 169.66 17.18 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 121.018 -1.052 . . . . 0.0 108.558 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.559 ' CD1' HG21 ' A' ' 44' ' ' VAL . 38.1 p90 -153.52 163.62 39.65 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 172.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -115.31 143.12 45.74 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -136.85 108.24 6.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.81 1.244 . . . . 0.0 107.872 -175.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -68.1 153.94 42.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-30 -52.2 -38.7 58.66 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 122.851 0.461 . . . . 0.0 112.121 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.79 -25.52 70.58 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-O 119.24 -0.755 . . . . 0.0 113.385 -177.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -69.31 -38.71 78.38 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.995 1.397 . . . . 0.0 109.979 175.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 27.0 mt -71.54 -43.56 71.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 125.452 1.501 . . . . 0.0 108.345 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.92 -40.84 85.75 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 125.03 1.332 . . . . 0.0 111.581 175.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -62.85 -42.06 99.6 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.566 0.698 . . . . 0.0 111.237 -177.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -68.46 -13.19 62.14 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.916 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.1 13.32 83.1 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.734 1.159 . . . . 0.0 112.953 -176.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -82.86 -173.74 4.85 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.431 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.4 t70 -141.89 147.49 37.21 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -53.72 -35.77 61.54 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.834 0.743 . . . . 0.0 111.443 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -79.78 -42.1 25.15 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.313 0.506 . . . . 0.0 109.863 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.431 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.92 -37.71 85.68 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.05 -1.031 . . . . 0.0 111.058 -175.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.63 -43.87 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.797 1.239 . . . . 0.0 110.254 170.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.59 -28.35 66.86 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.121 0.873 . . . . 0.0 113.057 177.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -120.92 8.79 10.51 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -155.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -132.18 98.17 4.34 Favored 'General case' 0 C--N 1.335 -0.053 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.2 ttp85 -54.27 -23.45 15.04 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.245 1.418 . . . . 0.0 114.74 -169.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -102.23 -31.16 10.69 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 118.902 0.774 . . . . 0.0 111.864 178.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -79.83 -17.47 53.2 Favored 'General case' 0 C--N 1.339 0.12 0 CA-C-N 119.068 0.849 . . . . 0.0 111.316 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 p -59.35 -53.3 59.81 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 167.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -30.94 63.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.316 1.846 . . . . 0.0 113.25 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.411 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.6 mm-40 -58.54 -34.29 70.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.53 1.132 . . . . 0.0 111.165 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -52.71 64.54 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 122.501 1.143 . . . . 0.0 109.023 175.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -67.82 -33.3 74.52 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 123.806 0.843 . . . . 0.0 109.851 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -63.23 -29.9 71.14 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.578 172.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -76.52 -45.11 32.24 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.289 1.404 . . . . 0.0 108.843 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.559 HG21 ' CD1' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -61.94 -49.33 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.631 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 36.8 tpp -63.81 -34.8 78.72 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.54 -177.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.04 -41.03 82.4 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 119.061 0.846 . . . . 0.0 111.212 174.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -35.78 78.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.768 0.427 . . . . 0.0 111.178 175.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.99 -13.06 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.088 178.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 52' ' ' GLU . 3.4 t-80 -60.01 -30.41 69.13 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -152.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -62.25 -21.09 64.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.12 0.873 . . . . 0.0 112.268 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -96.46 -1.66 46.94 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.629 1.572 . . . . 0.0 110.924 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 49' ' ' HIS . 46.1 mm-40 -135.61 -15.74 1.83 Allowed 'General case' 0 C--N 1.338 0.092 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -158.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.58 -10.22 4.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.298 1.039 . . . . 0.0 113.293 179.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -117.46 13.76 14.49 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.88 2.072 . . . . 0.0 111.365 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.59 -22.99 1.65 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.924 1.29 . . . . 0.0 113.074 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -70.81 -4.29 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 120.638 1.563 . . . . 0.0 113.728 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -55.23 -20.62 11.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.517 1.527 . . . . 0.0 114.021 159.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -93.32 -173.39 40.24 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.637 1.113 . . . . 0.0 112.661 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -68.55 173.18 10.23 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.584 2.856 . . . . 0.0 111.08 176.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.1 mt -146.22 149.96 34.91 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.636 1.175 . . . . 0.0 108.431 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -147.7 148.01 30.56 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.165 1.386 . . . . 0.0 108.012 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 2.4 mm -135.51 149.4 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -138.82 143.5 38.9 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 161.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.4 p -147.76 157.06 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 O-C-N 120.405 -1.435 . . . . 0.0 109.876 -168.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -149.78 150.98 32.83 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 167.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.66 145.27 29.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 164.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -126.23 -179.8 4.9 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.779 2.432 . . . . 0.0 107.858 173.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.08 -32.26 71.91 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -166.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.505 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.0 mmtm -140.64 23.08 2.31 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.214 1.005 . . . . 0.0 112.227 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.16 -170.24 38.62 Favored Glycine 0 C--N 1.332 0.325 0 O-C-N 120.917 -1.114 . . . . 0.0 110.895 -173.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.6 mp -131.06 148.15 52.71 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.744 1.617 . . . . 0.0 107.297 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -105.38 136.12 45.5 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 158.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -127.05 120.36 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 105.007 -2.22 . . . . 0.0 105.007 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -102.61 143.65 14.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 104.634 -2.358 . . . . 0.0 104.634 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.15 141.05 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 172.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -135.92 164.2 28.51 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.361 0.664 . . . . 0.0 109.676 -165.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.29 163.05 38.22 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.655 1.582 . . . . 0.0 108.158 172.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.29 158.16 21.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -63.9 132.16 49.91 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.7 tp -64.52 -34.31 77.94 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.234 0.614 . . . . 0.0 109.956 174.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -70.76 12.94 0.22 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.577 1.951 . . . . 0.0 114.095 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.81 -29.83 42.4 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.915 0.886 . . . . 0.0 111.136 172.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -134.16 167.25 21.0 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 158.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 50.8 tp -152.63 -34.13 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.062 1.345 . . . . 0.0 110.287 -176.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.02 -41.71 92.76 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.012 0.525 . . . . 0.0 110.495 169.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -79.31 115.13 18.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 164.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 45.6 mt -67.83 160.44 28.33 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.349 1.059 . . . . 0.0 110.067 173.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.5 m -63.73 158.63 59.24 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 162.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.37 154.72 14.17 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 124.0 3.133 . . . . 0.0 113.522 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 126.398 1.879 . . . . 0.0 107.432 179.049 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptm . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -127.55 79.61 1.9 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -152.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 mm -75.06 152.07 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 124.732 1.213 . . . . 0.0 109.804 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -141.95 148.35 38.49 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.579 1.952 . . . . 0.0 108.508 167.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.37 102.53 9.01 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.2 mm -70.93 -56.03 12.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 -170.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -162.61 -171.37 2.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.792 1.637 . . . . 0.0 108.84 -177.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.28 -6.12 8.91 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -118.91 -31.06 4.88 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.937 1.295 . . . . 0.0 111.601 -169.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 95.0 m -129.5 140.18 51.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.465 1.106 . . . . 0.0 109.278 -170.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.69 155.53 41.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 166.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -136.85 167.79 20.8 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.425 ' CE1' HG21 ' A' ' 44' ' ' VAL . 34.1 p90 -155.49 164.13 39.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.608 0.718 . . . . 0.0 109.351 172.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -114.93 142.61 46.36 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -136.43 115.53 12.42 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -72.77 158.66 35.15 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -53.61 -42.19 67.44 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 121.784 -0.573 . . . . 0.0 111.423 171.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.84 -27.05 69.51 Favored Glycine 0 CA--C 1.53 1.0 0 CA-C-O 119.167 -0.796 . . . . 0.0 113.043 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.92 -31.48 69.28 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.446 1.623 . . . . 0.0 110.778 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.8 mt -79.0 -43.97 24.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 124.837 1.255 . . . . 0.0 107.796 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -58.68 -40.71 84.36 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.289 1.436 . . . . 0.0 111.861 173.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.37 -44.62 95.44 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.165 0.986 . . . . 0.0 111.47 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -69.52 -6.88 33.63 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.578 173.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 12.91 84.16 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 124.465 1.031 . . . . 0.0 113.07 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -82.28 -174.28 5.04 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.419 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 7.7 t70 -137.35 144.65 42.64 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -55.63 -35.49 65.97 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.771 -0.633 . . . . 0.0 111.249 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -76.74 -44.49 33.01 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 118.708 0.686 . . . . 0.0 109.611 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.419 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.7 mm-40 -61.02 -37.7 83.49 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 121.389 -0.819 . . . . 0.0 111.311 -173.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -54.2 -45.82 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.78 0.832 . . . . 0.0 109.909 171.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -68.37 -22.2 64.67 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.452 1.024 . . . . 0.0 113.14 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -121.9 3.81 9.97 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -160.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -137.75 82.22 1.91 Allowed 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -178.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -46.28 -43.36 15.65 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.191 0.996 . . . . 0.0 113.654 -166.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.23 -32.21 64.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.684 -0.635 . . . . 0.0 111.683 -177.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -77.78 -20.39 53.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.647 -0.692 . . . . 0.0 110.968 174.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -52.72 62.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 166.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -52.59 -34.1 49.25 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.681 1.592 . . . . 0.0 113.311 -168.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -55.74 -36.32 67.13 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.979 1.311 . . . . 0.0 111.51 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -57.69 11.94 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.437 1.095 . . . . 0.0 108.829 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -62.6 -35.5 79.73 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.962 1.305 . . . . 0.0 110.033 -174.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -62.87 -39.37 94.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.114 171.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -68.35 -41.88 80.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.31 1.414 . . . . 0.0 110.232 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.425 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.3 m -68.72 -42.25 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 121.331 -0.856 . . . . 0.0 111.458 -178.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.9 mmt -54.5 -48.58 71.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.177 0.591 . . . . 0.0 109.674 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.74 -41.32 90.71 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 122.521 0.329 . . . . 0.0 111.498 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -65.53 -12.54 53.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.195 1.798 . . . . 0.0 112.488 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.64 1.16 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.266 1.026 . . . . 0.0 111.778 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.55 -20.82 65.05 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -163.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.04 -20.84 60.01 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.403 1.001 . . . . 0.0 112.13 173.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -103.72 5.96 36.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.138 1.375 . . . . 0.0 111.144 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.16 -20.95 4.74 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.806 1.243 . . . . 0.0 111.93 -173.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.51 -18.58 59.73 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.277 1.031 . . . . 0.0 113.768 -173.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -102.88 3.57 36.7 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.272 1.429 . . . . 0.0 111.761 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.71 40.91 1.3 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.123 1.769 . . . . 0.0 109.869 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.94 66.61 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -153.89 37.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 113.513 -1.676 . . . . 0.0 108.86 -168.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.9 -175.31 35.53 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 126.099 1.809 . . . . 0.0 109.906 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.44 172.27 12.63 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 123.5 2.8 . . . . 0.0 111.465 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 35.6 mt -135.65 154.18 51.39 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.219 1.408 . . . . 0.0 107.955 171.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.9 m95 -149.2 145.7 27.26 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 125.245 1.418 . . . . 0.0 107.519 -164.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mm -134.82 143.71 36.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -175.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -137.6 147.44 45.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.083 1.753 . . . . 0.0 106.67 165.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.1 p -150.39 155.66 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 O-C-N 120.647 -1.283 . . . . 0.0 109.719 -170.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -148.95 150.63 33.2 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 164.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.19 146.16 26.12 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 167.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.32 -177.49 4.09 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.779 2.432 . . . . 0.0 108.045 177.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.51 -33.8 73.16 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -139.6 23.6 2.48 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.464 1.106 . . . . 0.0 112.607 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -179.53 -165.26 33.34 Favored Glycine 0 CA--C 1.521 0.444 0 O-C-N 121.11 -0.994 . . . . 0.0 111.624 -173.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 mp -132.48 148.55 52.4 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.939 1.696 . . . . 0.0 108.041 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -103.33 138.62 39.84 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 156.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.414 HD13 ' CE2' ' A' ' 13' ' ' PHE . 1.1 mp -127.2 129.14 70.89 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.026 0 N-CA-C 104.92 -2.252 . . . . 0.0 104.92 -178.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -112.17 141.98 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 170.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.0 m -135.9 138.39 47.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 O-C-N 121.243 -0.911 . . . . 0.0 108.549 171.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -133.75 166.87 21.63 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.169 0.588 . . . . 0.0 110.726 -160.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -137.43 168.85 18.82 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.164 1.786 . . . . 0.0 110.241 167.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.47 144.05 43.56 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.172 171.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -72.89 172.42 10.91 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.104 0.962 . . . . 0.0 110.587 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 21.4 tp -133.14 37.86 3.37 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.031 1.333 . . . . 0.0 109.456 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -13.21 9.85 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.022 1.329 . . . . 0.0 114.066 -175.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -54.22 -30.73 51.04 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.001 1.273 . . . . 0.0 111.429 168.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.65 -8.11 5.99 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.094 1.358 . . . . 0.0 113.518 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.7 mt -129.74 -40.99 1.35 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.938 1.695 . . . . 0.0 110.021 -173.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.42 -31.98 71.7 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.606 0.762 . . . . 0.0 111.575 176.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -100.9 158.65 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.135 0.574 . . . . 0.0 109.523 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.91 151.4 47.19 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 172.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.2 m -140.12 159.26 64.79 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.576 1.55 . . . . 0.0 107.519 177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -75.19 163.24 35.3 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.555 2.17 . . . . 0.0 111.489 -176.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.256 1.397 0 C-N-CA 123.74 0.816 . . . . 0.0 108.805 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -146.03 136.95 24.46 Favored 'General case' 0 C--O 1.224 -0.274 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 -164.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.05 150.73 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 CA-C-N 120.589 1.54 . . . . 0.0 107.95 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.88 151.91 41.56 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.699 1.2 . . . . 0.0 111.013 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 tpp85 -117.68 87.15 2.65 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.651 1.98 . . . . 0.0 106.105 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.1 mm -57.1 -53.38 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.78 0.8 . . . . 0.0 109.166 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -152.85 -165.93 2.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.009 2.124 . . . . 0.0 106.32 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -78.25 0.41 25.35 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -128.97 -47.74 1.23 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.042 0.937 . . . . 0.0 111.931 -172.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 60.5 m -81.99 135.55 35.35 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 170.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.8 m -129.05 157.69 41.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 165.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -136.31 167.54 21.12 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 168.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.445 ' CE1' HG21 ' A' ' 44' ' ' VAL . 48.7 p90 -149.2 165.35 32.13 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 175.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -127.53 128.74 46.17 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 3.7 ttt -123.78 117.0 23.91 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.928 1.291 . . . . 0.0 108.28 -170.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.6 m -78.09 153.54 32.11 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.4 m-85 -58.36 -36.45 73.49 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.329 -0.857 . . . . 0.0 112.171 176.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.94 -29.8 75.76 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-O 119.456 -0.636 . . . . 0.0 112.238 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.47 -37.28 74.25 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 118.86 1.33 . . . . 0.0 110.474 177.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 33.0 mt -67.1 -48.84 77.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.803 1.241 . . . . 0.0 109.266 178.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -58.65 -38.98 79.29 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 125.467 1.507 . . . . 0.0 110.954 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.99 -41.12 91.51 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.989 0.899 . . . . 0.0 110.629 -175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.1 mtt85 -67.76 -9.19 41.85 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.174 1.39 . . . . 0.0 111.865 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.3 11.13 82.66 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.692 1.139 . . . . 0.0 113.014 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -86.38 -174.64 5.13 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 166.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -141.33 153.64 45.24 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.112 -0.992 . . . . 0.0 108.344 172.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -64.73 -28.5 69.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -167.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -87.19 -44.68 11.3 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -57.32 -35.77 70.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 112.95 -171.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.23 -55.8 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.895 1.278 . . . . 0.0 109.344 168.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -76.63 -14.16 60.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -119.87 6.52 10.9 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.899 0.88 . . . . 0.0 112.517 -167.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -129.0 86.22 2.41 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 170.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -52.27 -35.1 49.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -163.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -31.83 40.58 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.09 0.556 . . . . 0.0 111.672 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -79.94 -16.32 55.51 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.175 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.16 -50.58 72.6 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 167.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -54.62 -31.99 58.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.497 1.519 . . . . 0.0 112.694 -168.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.3 mm-40 -59.19 -36.23 74.98 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.016 1.326 . . . . 0.0 111.228 -177.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -57.84 10.94 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.32 1.048 . . . . 0.0 108.701 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -63.03 -34.19 77.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.153 0.981 . . . . 0.0 110.454 -173.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -62.88 -35.89 81.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.503 -0.76 . . . . 0.0 112.516 173.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -69.98 -43.71 70.91 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 120.091 1.314 . . . . 0.0 110.522 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.445 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.98 -37.99 70.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 O-C-N 121.163 -0.96 . . . . 0.0 111.526 -178.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 19.5 tpp -62.74 -39.72 94.99 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.064 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -57.84 -38.61 75.96 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 120.171 1.35 . . . . 0.0 111.561 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.92 -9.96 2.18 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.658 1.583 . . . . 0.0 113.541 173.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.2 t -129.27 -9.25 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 126.3 1.84 . . . . 0.0 110.54 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.03 -28.25 69.96 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.843 -1.161 . . . . 0.0 113.984 -157.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -60.7 -16.09 35.77 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.745 0.702 . . . . 0.0 112.396 176.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -114.14 6.79 16.44 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.167 1.787 . . . . 0.0 110.803 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -132.73 -18.33 2.43 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.886 1.274 . . . . 0.0 112.557 -172.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.9 -23.17 60.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.567 1.076 . . . . 0.0 112.993 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -98.75 5.6 47.45 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.8 1.64 . . . . 0.0 111.82 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.17 -15.72 2.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.067 1.347 . . . . 0.0 112.927 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.75 3.04 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 120.282 1.401 . . . . 0.0 113.697 173.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -57.16 -19.7 21.96 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.241 1.017 . . . . 0.0 113.077 155.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -107.97 -177.84 22.18 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.233 1.397 . . . . 0.0 111.762 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.02 170.16 19.6 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 123.614 2.876 . . . . 0.0 112.803 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.6 tp -144.32 153.76 42.33 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.121 1.768 . . . . 0.0 106.499 169.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -142.0 151.6 42.64 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.679 1.592 . . . . 0.0 107.05 -173.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.449 HG23 HG12 ' A' ' 75' ' ' VAL . 4.3 mm -139.27 139.22 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -170.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.22 167.53 22.2 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.793 1.237 . . . . 0.0 109.439 161.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.1 p -144.23 160.16 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.503 0.721 . . . . 0.0 109.864 -169.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -131.31 146.23 52.21 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 127.088 2.155 . . . . 0.0 105.574 163.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.66 129.92 55.34 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 167.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.405 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -118.7 -169.97 1.82 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 127.083 2.153 . . . . 0.0 108.272 -169.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.24 -43.2 96.28 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.9 mmtp -142.09 25.3 1.93 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.705 1.202 . . . . 0.0 112.367 -177.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -174.49 -170.52 37.78 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mp -135.53 143.54 45.8 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.889 1.276 . . . . 0.0 108.454 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.405 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.4 mt-10 -93.14 141.23 28.65 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 161.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -127.88 128.4 69.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -117.13 134.59 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 103.955 -2.609 . . . . 0.0 103.955 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.449 HG12 HG23 ' A' ' 62' ' ' ILE . 9.6 m -132.55 134.96 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.2 p -132.34 174.75 9.91 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.682 0.793 . . . . 0.0 110.573 -155.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -131.99 170.55 14.76 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 124.714 1.205 . . . . 0.0 111.566 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.73 171.99 7.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.959 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -134.06 166.94 21.56 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.701 1.6 . . . . 0.0 108.447 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.9 tp -134.49 32.34 3.35 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.491 1.117 . . . . 0.0 110.355 -172.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 m -74.72 45.03 0.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.833 1.653 . . . . 0.0 111.787 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -60.03 -21.18 61.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.388 1.075 . . . . 0.0 112.41 177.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -135.83 152.33 50.95 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 161.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.5 tp -162.24 -34.89 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.806 1.643 . . . . 0.0 109.768 -172.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -68.56 -38.01 80.39 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.116 0.566 . . . . 0.0 111.549 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -94.1 167.72 11.39 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.518 0.675 . . . . 0.0 109.225 167.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.3 tp -145.6 157.77 43.93 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.461 1.104 . . . . 0.0 109.485 -168.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.42 159.2 71.54 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.309 1.444 . . . . 0.0 107.769 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.89 164.92 32.49 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.646 2.231 . . . . 0.0 111.425 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 . . . . . 0 C--O 1.255 1.385 0 C-N-CA 123.786 0.834 . . . . 0.0 109.74 172.893 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ptm . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -130.02 130.22 44.68 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 125.457 1.503 . . . . 0.0 106.988 -169.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -122.63 153.1 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.967 1.258 . . . . 0.0 108.93 -171.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -142.18 151.73 42.48 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.931 1.292 . . . . 0.0 110.797 173.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -113.88 90.21 3.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.22 1.808 . . . . 0.0 106.504 177.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.5 mm -58.84 -53.03 53.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-O 121.981 0.896 . . . . 0.0 109.03 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -152.58 -166.97 2.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.488 2.315 . . . . 0.0 105.54 174.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -77.44 1.34 19.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.814 -1.179 . . . . 0.0 113.868 -173.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -129.94 -50.5 1.13 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.436 1.094 . . . . 0.0 111.116 -168.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 76.8 m -82.25 137.55 34.84 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.7 m -128.57 157.72 41.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.855 -1.906 . . . . 0.0 105.855 165.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -133.28 166.98 21.23 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 166.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.0 162.95 39.37 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -124.9 139.62 53.67 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.1 ttt -138.89 103.27 4.76 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -167.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.2 m -64.22 149.79 47.21 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.427 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.8 m-85 -55.13 -32.65 62.22 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -81.36 -11.66 83.05 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-O 118.573 -1.126 . . . . 0.0 113.426 -178.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.27 -42.96 82.98 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 120.169 1.984 . . . . 0.0 108.916 167.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -64.08 -45.4 96.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.13 1.372 . . . . 0.0 108.998 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 122.508 0.323 . . . . 0.0 111.531 -176.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.33 -40.64 97.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.718 0.771 . . . . 0.0 111.251 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtt-85 -65.9 -14.59 61.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 114.86 -1.063 . . . . 0.0 110.925 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 84.63 9.67 80.87 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 124.959 1.266 . . . . 0.0 112.762 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -83.61 -178.38 7.01 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 171.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -134.24 147.61 50.71 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -58.41 -31.1 67.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.431 -176.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -83.38 -47.14 11.76 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 173.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.05 -35.95 69.95 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.727 0.811 . . . . 0.0 112.522 -172.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -43.9 -55.82 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.465 1.106 . . . . 0.0 109.386 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -75.49 -16.26 60.32 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -172.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -116.92 7.7 13.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.748 0.819 . . . . 0.0 112.68 -166.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -136.51 88.9 2.41 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -48.95 -45.38 41.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -70.73 -30.79 67.41 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.617 -0.677 . . . . 0.0 111.007 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -78.42 -20.66 50.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.765 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.71 -49.3 71.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 167.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -53.49 -34.82 59.45 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.965 1.306 . . . . 0.0 112.68 -169.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.413 ' H ' ' HG2' ' A' ' 39' ' ' GLU . 1.9 mm-40 -58.19 -33.96 69.84 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.719 1.208 . . . . 0.0 111.389 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -54.07 51.02 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HA ' HG22 ' A' ' 44' ' ' VAL . 73.9 m-85 -67.15 -36.59 82.17 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.029 0.932 . . . . 0.0 110.263 -173.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.6 m95 -57.37 -36.48 71.29 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 118.153 -0.927 . . . . 0.0 112.167 172.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -68.63 -42.48 77.98 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.464 1.484 . . . . 0.0 111.085 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' A' ' 41' ' ' PHE . 13.5 m -75.19 -38.33 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 120.935 -1.103 . . . . 0.0 111.477 -175.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.8 mmt -59.98 -42.76 94.86 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.935 -0.555 . . . . 0.0 109.954 168.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.87 -41.25 82.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.045 0.839 . . . . 0.0 111.532 176.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -59.61 -9.34 2.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.373 1.869 . . . . 0.0 112.806 175.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -123.81 -8.33 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.25 1.82 . . . . 0.0 110.059 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -58.91 -28.08 65.86 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -163.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.38 -15.04 62.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.482 1.037 . . . . 0.0 112.462 177.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -112.3 -40.85 4.04 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.812 1.645 . . . . 0.0 109.236 174.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.73 -26.1 65.37 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.51 1.124 . . . . 0.0 112.118 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -57.5 -24.03 53.54 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.079 1.309 . . . . 0.0 112.569 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -78.83 -14.04 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.736 0.815 . . . . 0.0 112.09 176.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.21 8.57 2.47 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -164.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.16 69.1 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.936 1.35 . . . . 0.0 109.759 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -156.88 30.46 0.31 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.757 1.223 . . . . 0.0 110.088 -172.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 -179.88 37.84 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.373 0.987 . . . . 0.0 111.117 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.58 172.06 15.07 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.903 3.069 . . . . 0.0 112.317 -174.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 25.6 tp -135.93 154.32 51.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 125.404 1.482 . . . . 0.0 107.154 169.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -143.35 149.69 38.1 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.628 1.571 . . . . 0.0 107.256 -171.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mm -134.81 144.07 35.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.253 0.933 . . . . 0.0 109.728 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -138.57 150.54 46.43 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.638 1.975 . . . . 0.0 107.073 165.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.12 158.35 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.092 -1.005 . . . . 0.0 109.077 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.497 HE22 HD13 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -141.75 151.82 43.23 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 157.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.63 145.1 26.62 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 mp -124.27 -172.46 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.762 2.825 . . . . 0.0 107.714 -174.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -61.38 -37.84 84.87 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -167.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.7 mmtm -140.97 25.43 2.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.337 1.055 . . . . 0.0 112.569 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.76 -168.82 37.29 Favored Glycine 0 C--O 1.228 -0.255 0 O-C-N 120.98 -1.075 . . . . 0.0 110.551 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mp -135.01 145.34 47.99 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.729 1.211 . . . . 0.0 108.98 177.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -97.98 128.53 44.6 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 162.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.08 128.77 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.497 HD13 HE22 ' A' ' 65' ' ' GLN . 1.5 mp -109.58 142.05 23.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 173.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.53 136.71 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 171.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.4 p -128.21 174.57 9.16 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.179 0.992 . . . . 0.0 110.113 -160.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -130.5 178.65 6.45 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.969 1.308 . . . . 0.0 110.173 170.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.45 8.78 2.56 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.154 1.381 . . . . 0.0 113.887 -175.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -60.12 143.53 52.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.937 0.895 . . . . 0.0 110.301 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 45.7 tp -67.75 148.05 51.79 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 170.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -14.98 19.08 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.893 1.277 . . . . 0.0 114.366 -177.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -55.09 -32.85 62.3 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.754 -1.216 . . . . 0.0 111.102 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -71.2 7.43 1.28 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.068 1.347 . . . . 0.0 113.381 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.7 mt -135.3 -39.31 0.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.599 1.96 . . . . 0.0 109.177 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.16 -39.5 86.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.988 0.915 . . . . 0.0 112.097 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -64.77 141.1 58.89 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.411 0.55 . . . . 0.0 110.26 177.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.26 165.32 20.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.56 0.744 . . . . 0.0 109.517 173.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.1 m -135.58 160.92 65.93 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.32 1.448 . . . . 0.0 108.499 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.86 155.11 15.14 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.939 3.093 . . . . 0.0 113.195 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 . . . . . 0 C--O 1.252 1.212 0 CA-C-N 115.45 -0.795 . . . . 0.0 108.965 171.308 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptm . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 120.297 0.094 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -133.67 127.89 33.86 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 -170.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.1 mm -125.64 151.05 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.583 1.553 . . . . 0.0 107.957 -174.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -146.0 151.03 37.11 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.345 1.058 . . . . 0.0 110.885 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -112.4 101.98 10.14 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.333 1.853 . . . . 0.0 106.29 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.3 mm -70.17 -55.93 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -177.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -159.22 -170.5 3.01 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.141 1.376 . . . . 0.0 109.702 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.85 -15.74 5.35 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.206 1.403 . . . . 0.0 114.07 -175.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -124.72 -40.77 2.17 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.976 0.911 . . . . 0.0 111.468 -171.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.8 m -98.62 139.36 34.44 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 122.161 0.982 . . . . 0.0 109.305 -173.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 m -124.05 162.12 25.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 165.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.7 pttt -135.02 168.56 18.9 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.577 -0.702 . . . . 0.0 109.395 160.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 44' ' ' VAL . 45.6 p90 -146.44 168.97 19.85 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -132.33 140.0 48.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -135.28 114.47 12.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -170.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -74.52 154.87 38.47 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.486 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-30 -53.98 -32.14 53.03 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 175.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -90.02 -8.05 67.39 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.257 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -47.65 69.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.973 1.886 . . . . 0.0 107.755 162.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.1 mt -56.85 -47.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.179 1.392 . . . . 0.0 108.546 176.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.96 -36.75 80.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 117.971 0.351 . . . . 0.0 111.74 -176.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -64.12 -41.17 97.34 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.58 0.705 . . . . 0.0 110.581 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.34 -4.02 23.84 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.771 1.228 . . . . 0.0 111.153 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.73 7.82 86.83 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.958 1.266 . . . . 0.0 112.634 173.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -84.18 -172.27 4.07 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 168.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -146.09 152.89 40.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -59.07 -33.27 70.6 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 120.168 1.349 . . . . 0.0 111.913 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.12 -48.14 21.77 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -63.16 -33.99 76.66 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 123.507 0.723 . . . . 0.0 112.51 -170.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.86 -56.74 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 124.036 0.934 . . . . 0.0 108.539 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 35.2 m95 -77.17 -33.85 56.46 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 121.849 -0.532 . . . . 0.0 111.57 -171.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -89.46 4.44 49.12 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.229 0.611 . . . . 0.0 111.866 -166.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -139.1 88.6 2.29 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 54.0 ttp85 -51.45 -38.94 56.21 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -166.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -30.57 59.2 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.586 -0.696 . . . . 0.0 111.189 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -80.56 -15.66 56.09 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.27 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -51.76 66.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 166.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -55.91 -31.13 62.59 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.546 1.538 . . . . 0.0 112.554 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.93 -38.66 76.32 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.897 1.279 . . . . 0.0 111.543 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.421 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -59.54 -51.01 71.7 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.755 0.822 . . . . 0.0 109.223 176.668 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -65.24 -38.95 91.96 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.622 0.769 . . . . 0.0 110.41 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -60.46 -38.5 84.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 118.781 -0.628 . . . . 0.0 111.556 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -74.4 -33.98 63.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 119.708 1.14 . . . . 0.0 110.79 -174.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 13' ' ' PHE . 17.8 m -72.67 -43.04 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 119.295 0.952 . . . . 0.0 111.635 175.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.0 mmt -55.05 -45.44 75.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.081 0.552 . . . . 0.0 109.61 172.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.38 -43.81 92.84 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.451 0.3 . . . . 0.0 111.697 176.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -63.95 -13.24 44.44 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.26 1.424 . . . . 0.0 112.491 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.4 m -120.84 3.18 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.339 1.056 . . . . 0.0 111.586 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -18.84 63.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -164.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -61.5 -23.47 65.93 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.351 0.978 . . . . 0.0 111.657 173.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -89.2 -8.13 54.21 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.447 1.099 . . . . 0.0 111.21 175.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -124.15 -18.8 5.77 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.418 1.087 . . . . 0.0 112.327 -162.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.68 -26.16 61.29 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.625 1.102 . . . . 0.0 112.179 177.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -83.73 -7.49 59.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.588 1.155 . . . . 0.0 112.651 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.3 7.92 2.0 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.561 1.144 . . . . 0.0 113.515 -166.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.263 7.6 p -79.04 71.1 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 123.077 1.418 . . . . 0.0 109.374 175.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -161.66 37.77 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.89 1.676 . . . . 0.0 108.972 -172.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.31 -173.56 22.69 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.919 1.247 . . . . 0.0 111.188 -173.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.44 179.58 4.96 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.518 2.812 . . . . 0.0 111.311 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.78 135.62 22.28 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -141.95 149.6 40.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.42 1.088 . . . . 0.0 109.084 -171.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.4 mm -132.59 145.91 33.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.896 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -138.71 92.29 2.61 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.412 1.485 . . . . 0.0 107.541 160.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.54 153.95 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.665 0.786 . . . . 0.0 108.884 166.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 152.13 34.07 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 152.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.38 143.36 32.78 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.672 0.789 . . . . 0.0 110.09 -175.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.52 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -130.12 -178.82 4.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.997 2.519 . . . . 0.0 107.914 -173.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.41 -35.04 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -164.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.486 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.1 mmtm -141.94 27.03 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.44 1.096 . . . . 0.0 112.353 178.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.89 -172.46 42.37 Favored Glycine 0 CA--C 1.519 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 110.801 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -136.72 139.45 41.92 Favored 'General case' 0 CA--C 1.52 -0.204 0 C-N-CA 124.515 1.126 . . . . 0.0 109.387 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.52 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 15.1 mt-10 -90.89 143.46 26.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 162.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.43 118.9 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.75 146.93 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 168.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -139.32 119.29 14.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 -174.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -121.02 165.16 15.67 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.637 0.653 . . . . 0.0 110.057 -163.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -152.17 167.12 29.58 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.76 1.624 . . . . 0.0 108.655 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -144.51 103.28 3.93 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -142.25 169.42 17.62 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.792 0.837 . . . . 0.0 110.24 -171.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 56.8 tp -59.1 -29.72 67.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.302 1.041 . . . . 0.0 112.035 -175.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 m -61.99 1.57 0.28 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.685 1.594 . . . . 0.0 114.872 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.72 -30.25 13.38 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.795 0.838 . . . . 0.0 110.451 159.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -122.57 125.27 45.35 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 164.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.4 tp -150.98 -50.23 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.146 0.578 . . . . 0.0 110.31 -175.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -147.11 27.61 1.04 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 122.421 1.105 . . . . 0.0 111.182 -175.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.27 150.29 48.48 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.289 -176.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.35 158.87 30.57 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.423 0.689 . . . . 0.0 109.382 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.9 m -138.57 160.91 61.55 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 125.331 1.452 . . . . 0.0 108.626 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.06 155.71 14.55 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 124.246 3.297 . . . . 0.0 113.282 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 170.688 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 ptm . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -124.26 77.56 1.57 Allowed 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -158.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 mm -69.61 152.68 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.174 1.39 . . . . 0.0 110.422 -177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -140.19 149.95 43.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.069 1.747 . . . . 0.0 109.674 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -109.24 107.62 17.93 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 172.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.0 mm -73.64 -55.53 12.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.1 p30 -163.34 -175.76 4.42 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.297 1.839 . . . . 0.0 107.373 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.3 -24.32 59.18 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.381 -1.45 . . . . 0.0 113.04 -177.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -102.3 -25.75 13.55 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.944 0.897 . . . . 0.0 111.851 -169.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 75.6 m -128.04 137.07 52.04 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.247 1.022 . . . . 0.0 108.523 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 m -123.44 156.59 29.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 105.505 -2.035 . . . . 0.0 105.505 166.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 pttt -135.51 168.93 18.33 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 161.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -153.71 161.1 42.42 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -110.67 143.98 40.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 166.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.5 ttt -139.45 108.81 6.13 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 152.37 45.48 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.449 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 20.6 m-85 -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 123.02 0.528 . . . . 0.0 112.221 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.19 -25.44 69.68 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 119.058 -0.857 . . . . 0.0 113.402 -178.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -68.82 -38.94 80.22 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.301 1.551 . . . . 0.0 109.64 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.2 mt -71.37 -42.27 73.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 C-N-CA 125.016 1.326 . . . . 0.0 108.319 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.27 -39.55 90.8 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.787 1.235 . . . . 0.0 111.458 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -62.96 -42.1 99.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.624 0.726 . . . . 0.0 111.132 -177.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.8 mtt-85 -68.43 -11.52 59.82 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.221 173.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.55 12.34 84.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.613 1.102 . . . . 0.0 113.243 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -82.73 -175.07 5.6 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 167.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -137.2 152.83 50.32 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 170.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.8 ptt-85 -59.04 -27.69 65.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.797 1.239 . . . . 0.0 113.259 -175.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -91.52 -43.75 9.49 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.65 -34.16 70.9 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 124.245 1.018 . . . . 0.0 112.314 -174.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.7 mm -44.17 -56.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 C-N-CA 124.474 1.11 . . . . 0.0 109.128 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -74.62 -34.44 62.8 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.118 0.567 . . . . 0.0 112.06 -172.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -94.14 7.68 44.35 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -168.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -134.73 89.94 2.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -52.38 -37.42 56.29 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -164.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.22 -32.43 58.92 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.775 0.43 . . . . 0.0 111.704 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -76.66 -20.05 57.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.898 175.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.3 -50.84 70.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 168.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -35.01 62.21 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.92 1.288 . . . . 0.0 112.781 -169.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -58.12 -34.92 70.75 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.371 1.068 . . . . 0.0 111.193 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -54.8 42.62 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.074 0.95 . . . . 0.0 108.707 174.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.401 ' HA ' HG22 ' A' ' 44' ' ' VAL . 78.5 m-85 -64.85 -38.1 89.85 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.115 0.966 . . . . 0.0 110.181 -174.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -60.74 -37.8 83.0 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.344 -0.836 . . . . 0.0 112.584 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.54 -38.39 80.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 120.363 1.438 . . . . 0.0 111.513 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.401 HG22 ' HA ' ' A' ' 41' ' ' PHE . 18.9 m -74.04 -42.01 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 121.008 -1.057 . . . . 0.0 111.677 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -48.04 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.856 0.462 . . . . 0.0 109.959 168.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.19 -38.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 118.06 0.391 . . . . 0.0 111.788 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.16 -13.14 15.69 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.653 1.181 . . . . 0.0 112.993 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.96 16.05 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 124.98 1.312 . . . . 0.0 111.691 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -23.99 67.7 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.409 -0.807 . . . . 0.0 112.328 -169.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.53 -25.82 67.54 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -91.45 -44.92 8.83 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.54 0.736 . . . . 0.0 109.261 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -64.97 -26.78 68.44 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 118.314 -0.851 . . . . 0.0 112.187 -172.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -61.31 -9.85 5.96 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 120.338 1.426 . . . . 0.0 112.785 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -117.68 -0.77 11.74 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.578 1.551 . . . . 0.0 111.9 173.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.97 3.87 1.25 Allowed 'General case' 0 C--N 1.342 0.254 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -166.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . 0.267 7.9 p -81.32 57.0 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 120.254 1.388 . . . . 0.0 109.664 173.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -83.6 12.59 5.54 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.47 1.108 . . . . 0.0 112.361 -166.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.95 177.34 42.79 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.65 1.119 . . . . 0.0 110.635 -177.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.42 167.53 26.08 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.001 3.134 . . . . 0.0 111.017 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.91 147.98 49.56 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.42 0.629 . . . . 0.0 109.433 171.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -147.79 142.43 26.59 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 128.286 2.634 . . . . 0.0 104.296 173.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.572 HD12 ' N ' ' A' ' 63' ' ' GLN . 0.5 OUTLIER -144.15 152.55 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 120.309 1.413 . . . . 0.0 110.742 -175.225 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.572 ' N ' HD12 ' A' ' 62' ' ' ILE . 46.0 tt0 -137.83 148.93 45.89 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.384 1.874 . . . . 0.0 106.697 170.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 p -141.42 160.2 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 O-C-N 120.46 -1.4 . . . . 0.0 109.459 -176.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.408 HE22 HD13 ' A' ' 74' ' ' ILE . 0.4 OUTLIER -142.72 152.19 42.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 158.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -102.46 141.68 34.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -124.58 -174.84 3.12 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.927 2.491 . . . . 0.0 107.831 -172.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.29 -37.93 82.05 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -166.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 75.1 mmtt -140.45 25.67 2.2 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.339 1.056 . . . . 0.0 111.673 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.53 -170.4 39.08 Favored Glycine 0 C--O 1.227 -0.321 0 O-C-N 121.101 -1.0 . . . . 0.0 110.972 -174.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.16 146.27 44.75 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.803 1.241 . . . . 0.0 108.848 177.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -97.47 129.42 44.66 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 161.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.479 HG23 HD13 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -117.57 128.46 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 105.183 -2.154 . . . . 0.0 105.183 179.718 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.408 HD13 HE22 ' A' ' 65' ' ' GLN . 1.7 mp -103.56 145.16 13.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.03 134.87 42.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.5 p -134.02 175.9 9.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.677 0.791 . . . . 0.0 109.82 -164.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 4.8 mppt? -138.42 171.88 13.72 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.517 1.527 . . . . 0.0 108.644 171.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 178.79 0.23 Allowed 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.778 1.231 . . . . 0.0 111.371 174.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 55.88 45.29 24.38 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.943 1.297 . . . . 0.0 110.123 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 39.33 1.48 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.441 1.896 . . . . 0.0 106.894 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 m -134.68 20.51 3.57 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.283 -146.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.48 -34.23 66.73 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.308 0.643 . . . . 0.0 110.646 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -139.07 125.48 20.4 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 163.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.0 tp -130.55 -28.28 2.07 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.903 1.281 . . . . 0.0 110.378 -170.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -63.89 -21.46 66.47 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.317 0.647 . . . . 0.0 111.709 165.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.256 69.9 mmtt 52.7 54.0 11.27 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.025 1.73 . . . . 0.0 110.139 -166.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.7 pp -56.98 160.04 3.8 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.26 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.87 160.23 65.47 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 108.732 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.27 156.77 12.74 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.148 3.232 . . . . 0.0 113.193 174.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 65.5 mtp85 . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.926 1.69 . . . . 0.0 107.85 177.061 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -139.78 78.72 1.68 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -145.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 mm -67.6 153.69 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 124.142 0.977 . . . . 0.0 109.404 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -142.92 152.65 42.27 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.731 1.613 . . . . 0.0 110.303 172.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.5 tpp85 -114.69 90.95 3.46 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.912 1.685 . . . . 0.0 106.758 177.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.42 -53.23 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 122.023 0.916 . . . . 0.0 109.019 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.1 p-10 -151.45 -168.76 3.18 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.597 2.359 . . . . 0.0 105.558 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -77.84 5.18 10.1 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.084 -1.01 . . . . 0.0 113.69 -172.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -130.68 -55.14 1.07 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.289 1.036 . . . . 0.0 110.682 -171.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.4 m -77.38 138.6 39.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 171.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.4 m -125.36 160.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 166.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.2 pttt -134.29 168.95 17.95 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 160.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.0 142.42 25.23 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 170.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -94.05 137.94 32.69 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 165.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.4 ttt -131.24 116.71 18.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -174.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -76.27 154.06 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.405 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -56.66 -39.06 73.08 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.524 -0.735 . . . . 0.0 112.209 177.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.54 -24.61 73.88 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.763 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -28.63 64.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.083 1.442 . . . . 0.0 110.627 174.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.54 -43.45 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.825 1.25 . . . . 0.0 107.661 178.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.17 -39.58 82.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.565 1.146 . . . . 0.0 111.327 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.13 -45.25 92.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.247 1.019 . . . . 0.0 111.276 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.7 mtt85 -69.03 -6.89 30.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.341 1.056 . . . . 0.0 111.527 172.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.65 12.91 84.03 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.547 1.07 . . . . 0.0 113.194 176.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.69 -174.06 4.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 167.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -139.05 149.69 44.9 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.1 ptt180 -62.38 -31.4 72.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -168.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.54 -44.1 12.95 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 173.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -56.62 -35.92 68.85 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.309 1.044 . . . . 0.0 112.69 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.1 mm -43.51 -50.98 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 124.791 1.236 . . . . 0.0 110.683 169.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.4 m95 -80.22 -12.95 59.58 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.259 1.024 . . . . 0.0 113.55 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -123.03 7.28 9.24 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -166.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -124.98 99.41 6.12 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 172.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 46.2 ptt85 -60.27 -14.29 17.26 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -163.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -30.37 7.32 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.563 1.545 . . . . 0.0 111.891 178.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -79.53 -14.96 58.51 Favored 'General case' 0 C--N 1.339 0.151 0 O-C-N 121.3 -0.875 . . . . 0.0 111.322 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.5 p -52.19 -57.5 9.45 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.171 0.989 . . . . 0.0 109.533 163.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.48 -32.06 64.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.232 1.813 . . . . 0.0 112.522 -167.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 3.2 mm-40 -60.01 -34.8 73.84 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.661 1.185 . . . . 0.0 111.219 -176.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -51.94 67.76 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 174.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -66.18 -38.43 88.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.429 0.691 . . . . 0.0 109.924 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -58.34 -37.55 75.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.627 -0.702 . . . . 0.0 112.097 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -64.39 -39.68 94.32 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.022 1.283 . . . . 0.0 111.134 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.8 m -82.47 -39.39 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 O-C-N 121.086 -1.009 . . . . 0.0 112.33 -176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 mmt -53.14 -47.07 69.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.408 0.683 . . . . 0.0 109.422 166.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.84 -42.0 78.89 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.575 0.625 . . . . 0.0 111.84 177.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -59.73 -14.86 16.15 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.082 1.353 . . . . 0.0 113.08 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 15.3 m -129.76 2.75 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 C-N-CA 124.396 1.078 . . . . 0.0 111.976 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -24.32 67.68 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -162.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.82 -15.94 35.54 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.66 0.664 . . . . 0.0 112.115 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -113.38 3.14 15.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.868 1.667 . . . . 0.0 110.957 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -115.18 -21.34 10.0 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.228 1.411 . . . . 0.0 111.346 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.31 -15.84 18.38 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -176.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -112.67 6.48 18.26 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.512 1.525 . . . . 0.0 112.003 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -136.37 0.92 2.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.157 1.383 . . . . 0.0 113.217 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -78.29 73.17 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 122.947 1.356 . . . . 0.0 109.415 172.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -153.64 32.42 0.45 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.012 1.325 . . . . 0.0 109.555 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.13 -178.16 35.78 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.084 1.326 . . . . 0.0 110.84 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -71.91 171.15 17.19 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.7 2.933 . . . . 0.0 112.197 -174.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.93 152.08 46.08 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.588 1.555 . . . . 0.0 107.121 171.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -144.11 150.51 38.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.96 1.304 . . . . 0.0 107.683 -168.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mm -135.0 144.72 33.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -172.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.63 170.59 15.56 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 148.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.27 159.6 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 O-C-N 121.513 -0.742 . . . . 0.0 110.702 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -129.18 145.37 51.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.751 2.42 . . . . 0.0 105.409 167.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.42 132.0 54.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 168.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.14 -169.81 1.86 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.415 2.286 . . . . 0.0 108.496 -170.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.87 -41.84 98.34 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -169.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 33.0 mmtp -140.11 22.9 2.41 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.697 1.199 . . . . 0.0 112.445 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.19 -168.44 36.38 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mp -135.62 146.77 48.23 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.462 1.505 . . . . 0.0 108.725 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -100.83 122.67 43.81 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 164.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.73 127.25 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 105.045 -2.205 . . . . 0.0 105.045 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -109.93 142.1 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -137.17 115.14 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -170.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -117.24 171.04 8.22 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.582 0.628 . . . . 0.0 110.435 -163.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -134.73 175.99 9.05 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.237 1.415 . . . . 0.0 109.768 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.64 154.59 28.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.146 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -61.73 140.01 58.25 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 49.2 tp -145.74 130.55 18.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -69.16 -3.85 15.13 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -166.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -56.28 -41.99 76.75 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.176 1.353 . . . . 0.0 109.832 169.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.03 34.63 0.41 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.203 1.001 . . . . 0.0 111.321 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 tt -145.51 -47.52 0.22 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.686 1.995 . . . . 0.0 106.821 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.07 -44.87 95.75 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.215 1.006 . . . . 0.0 111.43 172.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -72.73 138.72 46.73 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -149.33 171.18 16.95 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.264 1.426 . . . . 0.0 110.749 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.69 160.22 68.44 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 124.719 1.208 . . . . 0.0 108.811 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -55.58 159.36 11.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.1 3.2 . . . . 0.0 113.049 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 . . . . . 0 C--O 1.255 1.363 0 C-N-CA 125.891 1.677 . . . . 0.0 107.837 175.361 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.977 0.418 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -127.49 74.97 1.56 Allowed 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 -149.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 mm -69.29 152.56 9.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.106 1.362 . . . . 0.0 110.167 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.64 152.42 45.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.437 1.895 . . . . 0.0 109.869 172.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.9 tpp85 -118.29 91.61 3.61 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.178 1.791 . . . . 0.0 106.185 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.33 -53.38 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.4 p30 -156.92 -166.88 2.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.787 2.035 . . . . 0.0 106.54 175.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.17 2.58 23.68 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.748 -1.22 . . . . 0.0 113.886 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -129.66 -29.2 2.18 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 125.164 1.386 . . . . 0.0 111.894 -169.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 62.9 m -111.53 133.07 54.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.526 1.53 . . . . 0.0 107.849 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.7 m -122.65 159.25 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 165.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -139.26 172.19 13.18 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 161.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 35.9 p90 -150.49 169.81 20.6 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 169.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -122.5 144.23 49.21 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 167.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 6.7 ttt -137.48 114.89 11.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 -173.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.24 158.08 35.87 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.3 m-30 -53.01 -39.07 62.87 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.549 -0.72 . . . . 0.0 111.982 172.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.31 -25.74 73.58 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 119.451 -0.638 . . . . 0.0 113.051 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -34.53 76.55 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.979 1.389 . . . . 0.0 110.027 173.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 32.4 mt -76.88 -43.1 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.843 1.257 . . . . 0.0 107.907 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.83 -40.77 80.84 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.075 1.35 . . . . 0.0 111.397 174.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.31 -43.37 98.99 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.594 0.758 . . . . 0.0 111.312 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.1 mtt85 -70.85 -7.55 46.29 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.46 174.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.22 13.0 84.08 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.695 1.141 . . . . 0.0 112.952 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -82.41 -175.02 5.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.427 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.3 t70 -140.1 147.43 40.24 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -54.76 -38.06 66.75 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.232 0.924 . . . . 0.0 111.04 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -75.6 -45.0 40.09 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.427 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.6 mm-40 -61.1 -38.22 85.54 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.319 -0.863 . . . . 0.0 111.331 -173.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -54.95 -45.49 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 123.796 0.839 . . . . 0.0 109.773 171.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -69.03 -22.68 64.03 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.488 1.04 . . . . 0.0 112.974 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -120.46 3.93 10.73 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -161.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -137.79 82.4 1.92 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -47.7 -42.3 24.63 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -166.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.38 -31.59 63.99 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.66 -0.65 . . . . 0.0 111.417 -178.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.57 -20.41 54.09 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.525 -0.75 . . . . 0.0 110.96 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.72 -52.08 64.66 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 166.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -54.8 -32.33 60.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.303 1.441 . . . . 0.0 113.092 -168.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.92 -37.63 69.18 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.539 1.136 . . . . 0.0 111.671 -178.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.458 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -61.32 -50.08 74.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.493 0.717 . . . . 0.0 109.689 177.573 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -65.16 -38.41 90.47 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.531 0.732 . . . . 0.0 109.573 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -59.87 -34.88 73.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.095 171.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.8 -40.49 69.16 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 120.622 1.556 . . . . 0.0 110.529 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.4 m -70.88 -41.26 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.258 -0.901 . . . . 0.0 110.927 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.2 mmt -57.95 -42.67 85.43 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.113 0.565 . . . . 0.0 110.49 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.0 -41.3 97.9 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.757 0.708 . . . . 0.0 111.779 176.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -63.37 -13.19 36.69 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.636 1.574 . . . . 0.0 111.864 174.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.5 t -109.66 -5.08 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.983 1.713 . . . . 0.0 109.655 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -56.43 -31.08 63.59 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -161.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.52 -14.67 58.52 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.225 0.92 . . . . 0.0 112.94 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -114.26 -36.9 4.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.99 1.716 . . . . 0.0 109.923 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.87 -28.02 65.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.699 1.199 . . . . 0.0 111.521 175.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.21 -24.93 57.86 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.405 1.002 . . . . 0.0 112.609 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -83.14 -9.89 58.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.073 0.949 . . . . 0.0 111.983 177.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -135.49 8.64 3.37 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 0.0 113.149 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.6 p -84.68 61.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 123.269 1.509 . . . . 0.0 109.15 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -156.08 31.69 0.34 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.676 1.19 . . . . 0.0 109.457 -171.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -173.87 -177.35 43.01 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.996 1.76 . . . . 0.0 109.328 -172.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.23 173.29 11.61 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.466 2.778 . . . . 0.0 112.116 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.3 tp -138.23 150.06 46.36 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 170.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -142.98 149.73 38.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.547 1.139 . . . . 0.0 107.974 -170.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mm -134.31 144.76 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -171.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -142.9 151.62 41.21 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 162.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.7 p -145.22 158.63 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.455 -1.403 . . . . 0.0 109.821 -166.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -136.32 152.21 50.43 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.58 133.18 49.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 158.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.544 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -123.51 178.26 5.26 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.544 1.938 . . . . 0.0 108.099 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.13 -31.85 70.46 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -165.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.536 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.5 mmtm -140.68 21.81 2.33 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.426 1.09 . . . . 0.0 112.656 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.29 -168.27 36.83 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 120.841 -1.162 . . . . 0.0 111.637 -174.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.7 mp -133.08 138.98 46.91 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.285 1.834 . . . . 0.0 107.4 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.544 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 28.4 mt-10 -94.6 143.95 26.0 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 157.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.6 mt -141.62 121.66 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -107.37 142.6 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.53 129.09 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -134.23 168.5 18.75 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 118.923 0.783 . . . . 0.0 111.26 -163.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -136.37 168.43 19.46 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 126.047 1.739 . . . . 0.0 109.787 168.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.68 137.08 58.22 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 114.296 -1.32 . . . . 0.0 107.925 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -158.6 159.37 35.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.936 1.295 . . . . 0.0 108.749 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.6 tp -144.2 56.31 1.31 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.203 1.001 . . . . 0.0 108.53 -173.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.4 m -71.11 35.39 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.735 2.014 . . . . 0.0 113.433 -175.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -64.83 -42.84 94.62 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 120.878 -1.139 . . . . 0.0 109.458 174.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.61 106.69 7.29 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 167.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.5 tp -158.25 -40.68 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -68.85 -27.59 65.95 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -175.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -61.99 147.36 47.3 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.33 0.652 . . . . 0.0 110.826 -177.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.4 158.77 28.47 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.363 0.665 . . . . 0.0 109.529 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.7 m -138.12 161.47 59.35 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 125.259 1.424 . . . . 0.0 108.464 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -53.78 156.35 12.22 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 124.086 3.191 . . . . 0.0 113.348 175.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.954 1.702 . . . . 0.0 108.073 177.457 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptm . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 110.851 -0.055 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -132.26 127.88 36.66 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -168.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 37.8 mm -123.77 151.15 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 125.083 1.353 . . . . 0.0 107.976 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -148.31 130.03 15.08 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.595 0.758 . . . . 0.0 110.827 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 tpp180 -88.45 110.78 21.11 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.433 HD11 ' HG2' ' A' ' 12' ' ' LYS . 27.1 mm -74.47 -58.16 5.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.239 0 N-CA-C 108.488 -0.931 . . . . 0.0 108.488 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -157.62 -173.98 4.65 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.605 1.562 . . . . 0.0 108.787 -177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -56.38 -14.81 3.23 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -174.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -121.09 -46.69 2.31 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.795 1.238 . . . . 0.0 110.879 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 86.1 m -94.7 142.3 27.61 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.93 0.872 . . . . 0.0 109.621 -172.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.8 m -126.13 163.72 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 166.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.433 ' HG2' HD11 ' A' ' 6' ' ' ILE . 48.2 pttt -134.04 169.13 17.59 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.496 -0.752 . . . . 0.0 109.243 160.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -147.07 167.09 24.96 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 123.831 0.853 . . . . 0.0 108.699 172.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -132.97 143.58 49.55 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 170.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.3 ttt -141.8 112.02 6.93 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -168.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.0 m -70.91 156.06 40.06 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 175.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -55.33 -40.5 71.26 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 121.389 -0.819 . . . . 0.0 111.978 176.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -76.86 -12.98 84.08 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 118.612 -1.105 . . . . 0.0 113.769 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.02 -33.74 76.49 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.858 1.829 . . . . 0.0 109.282 166.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.5 mt -77.81 -40.9 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.96 -37.16 81.43 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.207 0.458 . . . . 0.0 111.584 175.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -64.5 -42.43 95.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.87 0.843 . . . . 0.0 111.182 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 75.6 mtt85 -70.1 -8.02 46.14 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.37 -1.286 . . . . 0.0 111.386 173.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.09 12.81 84.29 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.492 1.044 . . . . 0.0 112.988 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -83.6 -171.87 3.83 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 165.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -139.61 148.17 42.11 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.5 ptt85 -57.96 -31.05 66.49 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 118.77 -0.633 . . . . 0.0 112.064 -177.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -83.1 -46.07 13.23 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.35 -36.46 68.81 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.811 0.844 . . . . 0.0 112.472 -173.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mm -46.03 -48.97 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.508 1.123 . . . . 0.0 110.342 171.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -80.45 -13.35 59.19 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.939 1.088 . . . . 0.0 113.939 -175.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -122.01 10.87 10.19 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.046 0.839 . . . . 0.0 112.731 -166.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -133.63 99.26 4.43 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -58.75 -15.61 12.91 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -164.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.4 -30.83 7.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.463 1.505 . . . . 0.0 111.708 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -78.5 -15.7 58.31 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 118.923 0.783 . . . . 0.0 111.597 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.0 p -53.56 -60.69 2.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.036 0.935 . . . . 0.0 109.477 164.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -58.46 -29.15 65.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.854 1.662 . . . . 0.0 112.454 -165.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -57.12 -38.15 73.04 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.728 1.211 . . . . 0.0 111.394 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.424 ' C ' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.2 -55.59 32.96 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.164 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -63.02 -35.98 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.565 1.146 . . . . 0.0 110.635 -175.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.7 m95 -63.8 -38.4 90.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.686 -1.149 . . . . 0.0 112.018 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -68.62 -45.54 71.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.737 1.608 . . . . 0.0 109.868 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.6 -45.97 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 O-C-N 121.489 -0.757 . . . . 0.0 110.581 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.5 tpp -61.85 -37.05 83.04 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.868 -0.52 . . . . 0.0 109.946 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -64.92 -41.86 95.19 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.074 0.852 . . . . 0.0 111.511 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.96 -41.48 98.04 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.549 1.14 . . . . 0.0 110.186 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.7 t -73.5 -16.87 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.685 1.194 . . . . 0.0 111.174 176.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -58.15 -26.31 62.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.68 1.582 . . . . 0.0 115.22 -157.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -58.9 -22.71 60.01 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.608 1.095 . . . . 0.0 112.122 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -95.16 -2.14 50.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.326 1.45 . . . . 0.0 111.615 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -134.09 -16.73 2.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.361 1.065 . . . . 0.0 112.567 -161.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.82 -17.43 36.07 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.447 1.099 . . . . 0.0 113.44 -178.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -107.17 3.69 25.96 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.703 1.601 . . . . 0.0 111.684 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.54 18.75 2.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.43 1.492 . . . . 0.0 112.14 -175.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.3 p -92.07 73.26 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 122.856 1.312 . . . . 0.0 107.694 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -152.96 31.78 0.49 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.004 -172.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.72 -179.22 37.16 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.061 1.315 . . . . 0.0 110.467 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -71.83 170.32 19.06 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.521 2.814 . . . . 0.0 112.001 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 49.1 mt -135.45 155.53 50.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.501 1.52 . . . . 0.0 107.731 171.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -150.62 147.22 27.14 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.441 1.497 . . . . 0.0 107.201 -162.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 8.4 mm -131.81 141.27 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -136.73 88.89 2.4 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.706 1.602 . . . . 0.0 106.798 167.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.21 154.41 8.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 166.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.66 152.3 33.78 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 152.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.0 143.36 33.29 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.515 0.726 . . . . 0.0 109.617 -175.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.527 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -129.51 -175.83 3.71 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 127.947 2.499 . . . . 0.0 107.898 -171.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.0 -38.25 82.06 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -164.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.47 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.8 mmtm -142.3 28.15 1.69 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.557 1.143 . . . . 0.0 111.746 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.13 -172.61 41.04 Favored Glycine 0 CA--C 1.517 0.165 0 O-C-N 121.14 -0.975 . . . . 0.0 110.876 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mp -135.58 139.77 44.12 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 124.392 1.077 . . . . 0.0 109.447 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.527 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 18.9 mt-10 -90.79 145.74 24.54 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 161.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.0 mt -134.97 122.59 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 106.789 -1.559 . . . . 0.0 106.789 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.8 mp -93.99 146.57 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 169.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.7 118.24 11.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 -171.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.4 p -124.55 173.87 8.19 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.81 0.732 . . . . 0.0 111.44 -159.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -135.9 173.69 11.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.179 1.392 . . . . 0.0 109.972 165.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.42 148.82 51.07 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.4 164.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -134.4 34.27 3.26 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.517 1.127 . . . . 0.0 109.457 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp 48.02 44.55 18.89 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.582 1.553 . . . . 0.0 109.559 -166.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -69.45 -8.61 48.36 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -154.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -56.11 -37.67 69.74 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.767 -1.208 . . . . 0.0 110.1 166.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -72.95 4.04 4.66 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.874 1.27 . . . . 0.0 112.943 177.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.7 mt -121.88 -35.55 3.17 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.954 1.702 . . . . 0.0 109.564 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -67.01 -43.11 83.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.717 0.807 . . . . 0.0 110.522 168.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -76.72 156.92 32.12 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-O 121.023 0.44 . . . . 0.0 109.912 170.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.8 tp -149.91 157.55 43.29 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.902 0.881 . . . . 0.0 109.713 -167.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.6 m -138.15 161.56 58.78 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.014 1.326 . . . . 0.0 108.683 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.92 157.14 13.66 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.087 3.191 . . . . 0.0 113.235 175.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.243 0 C-N-CA 124.008 0.923 . . . . 0.0 108.666 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.551 0.204 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -135.62 130.88 35.07 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 125.418 1.487 . . . . 0.0 106.998 -170.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.8 mm -122.39 152.35 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.51 1.524 . . . . 0.0 108.646 -173.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -143.92 149.29 36.63 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.21 1.404 . . . . 0.0 110.617 169.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -112.5 102.4 10.51 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.206 -1.776 . . . . 0.0 106.206 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.7 mm -70.98 -55.3 14.53 Favored 'Isoleucine or valine' 0 C--N 1.342 0.257 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.2 p30 -163.03 -170.39 2.31 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.99 1.716 . . . . 0.0 107.863 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.19 -20.05 63.77 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.729 -1.232 . . . . 0.0 112.509 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -108.25 -30.4 8.38 Favored 'General case' 0 CA--C 1.522 -0.103 0 O-C-N 121.136 -0.977 . . . . 0.0 111.606 -163.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 90.6 m -123.1 138.72 54.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.788 1.235 . . . . 0.0 108.755 -178.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -125.92 157.25 35.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 162.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -135.38 167.45 21.02 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 166.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.544 ' CE1' HG21 ' A' ' 44' ' ' VAL . 55.2 p90 -152.68 167.95 27.27 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -130.31 137.07 49.76 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 2.2 tpt -132.88 106.76 7.9 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -168.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -68.4 156.29 38.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 175.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.46 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 19.6 m-85 -55.66 -37.02 67.73 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 121.487 -0.758 . . . . 0.0 111.425 173.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.05 -32.33 83.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.371 -0.683 . . . . 0.0 112.723 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -40.17 85.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.173 1.486 . . . . 0.0 110.05 177.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 31.6 mt -67.0 -49.28 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.827 1.251 . . . . 0.0 109.116 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -59.63 -38.18 80.65 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 126.042 1.737 . . . . 0.0 111.293 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.76 -40.2 91.82 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 122.034 0.921 . . . . 0.0 110.521 -175.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -70.57 -7.95 47.85 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 114.282 -1.326 . . . . 0.0 111.611 173.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.42 10.31 84.72 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.926 1.25 . . . . 0.0 113.234 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -84.04 -178.5 6.99 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 168.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.47 151.14 45.96 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.024 -1.047 . . . . 0.0 108.562 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -62.95 -31.22 72.27 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -166.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.54 -42.37 13.58 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -60.53 -34.82 74.67 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 123.729 0.812 . . . . 0.0 112.175 -172.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.4 mm -41.75 -57.26 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.418 1.087 . . . . 0.0 109.137 167.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.411 ' CZ2' HG21 ' A' ' 64' ' ' VAL . 63.0 m95 -73.17 -38.68 66.1 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 122.821 0.449 . . . . 0.0 111.664 -173.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -89.34 4.14 49.88 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -169.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -130.74 84.31 2.18 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 105.149 -2.167 . . . . 0.0 105.149 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -51.6 -41.87 61.53 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.394 -0.816 . . . . 0.0 112.687 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -28.48 66.71 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.49 -0.756 . . . . 0.0 111.712 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -81.61 -18.45 44.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.417 -0.802 . . . . 0.0 111.299 175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.33 -46.69 85.47 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 163.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.537 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 8.6 tt0 -53.89 -32.91 54.96 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.213 1.005 . . . . 0.0 113.415 -171.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.427 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 1.0 OUTLIER -67.25 -32.71 73.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.422 1.489 . . . . 0.0 111.028 -176.326 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -47.34 85.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' A' ' 38' ' ' GLU . 1.4 m-30 -68.97 -43.31 75.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.295 1.038 . . . . 0.0 109.521 -173.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -54.91 -39.47 68.83 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 118.471 -0.776 . . . . 0.0 111.533 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.8 -39.2 90.7 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.557 1.071 . . . . 0.0 111.333 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.544 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.5 m -78.39 -39.19 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.002 -1.061 . . . . 0.0 112.02 -174.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.5 mmm -55.32 -48.11 74.63 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.3 -38.23 79.72 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.39 -16.57 9.48 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.439 1.495 . . . . 0.0 112.733 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 m -135.87 12.01 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 125.386 1.474 . . . . 0.0 111.117 -173.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -21.45 62.59 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -160.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -58.71 -28.34 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.996 0.918 . . . . 0.0 111.254 174.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -90.63 3.15 54.94 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.363 1.465 . . . . 0.0 111.327 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -134.31 -24.81 1.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 O-C-N 121.237 -0.914 . . . . 0.0 112.822 -161.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -57.28 -22.93 45.02 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.106 0.963 . . . . 0.0 113.134 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -95.53 4.52 53.11 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.115 1.366 . . . . 0.0 112.359 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.25 -24.46 2.07 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.444 1.098 . . . . 0.0 113.153 -175.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -73.43 1.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 120.142 1.337 . . . . 0.0 113.336 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -56.7 -18.53 12.69 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.123 1.369 . . . . 0.0 113.366 156.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -106.57 -173.44 23.04 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.433 1.492 . . . . 0.0 111.911 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.46 171.69 12.57 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.421 2.747 . . . . 0.0 111.832 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.434 HD13 ' H ' ' A' ' 61' ' ' TRP . 0.1 OUTLIER -137.98 152.1 48.58 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.346 1.459 . . . . 0.0 107.442 175.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.434 ' H ' HD13 ' A' ' 60' ' ' LEU . 95.3 m95 -147.85 145.04 28.55 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 125.598 1.559 . . . . 0.0 107.615 -164.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -133.79 141.28 44.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -138.24 159.39 42.17 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.77 2.028 . . . . 0.0 107.27 167.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.411 HG21 ' CZ2' ' A' ' 31' ' ' TRP . 7.1 p -146.87 162.53 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 O-C-N 120.553 -1.342 . . . . 0.0 110.968 -170.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.36 149.01 52.44 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 126.862 2.065 . . . . 0.0 106.041 160.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.07 129.59 55.47 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 167.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.421 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 5.0 mp -118.9 -175.3 2.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 108.319 -170.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.28 -35.52 80.61 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -166.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.5 mmtm -141.42 23.93 2.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.346 1.059 . . . . 0.0 112.124 -178.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.05 -171.4 40.58 Favored Glycine 0 N--CA 1.454 -0.138 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mp -136.77 143.08 43.04 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.432 1.093 . . . . 0.0 108.341 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.421 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.5 mt-10 -90.25 141.46 28.69 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 161.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.405 HD12 ' C ' ' A' ' 72' ' ' GLU . 0.7 OUTLIER -127.98 132.36 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 175.197 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.4 mp -112.5 139.05 39.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 104.406 -2.442 . . . . 0.0 104.406 177.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.26 142.22 41.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 119.302 0.955 . . . . 0.0 109.935 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.3 p -136.86 170.86 15.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.411 0.684 . . . . 0.0 110.193 -159.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -137.66 154.63 49.67 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.862 1.265 . . . . 0.0 108.9 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.75 -25.57 66.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -168.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -64.97 -32.7 74.54 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.217 -178.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 34.07 46.89 0.17 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.938 2.495 . . . . 0.0 114.736 168.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.6 m 55.85 20.49 4.16 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.923 1.689 . . . . 0.0 114.75 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -59.83 -44.49 94.03 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 120.934 -1.104 . . . . 0.0 108.376 167.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -77.09 34.24 0.15 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.737 1.615 . . . . 0.0 111.619 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt -143.74 -46.19 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.519 1.927 . . . . 0.0 107.07 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.69 -45.77 92.92 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 169.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -74.35 135.55 42.48 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 165.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.1 159.18 31.44 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.908 0.883 . . . . 0.0 110.057 -178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.9 m -136.73 158.57 72.84 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 125.16 1.384 . . . . 0.0 108.652 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.23 164.51 30.99 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.742 2.294 . . . . 0.0 111.194 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 57.3 mtm180 . . . . . 0 C--O 1.253 1.244 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 171.015 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.498 1.963 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -130.2 127.06 38.9 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -170.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 mm -121.55 150.43 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.876 1.27 . . . . 0.0 108.861 -170.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -146.45 150.4 35.55 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.047 1.339 . . . . 0.0 109.923 172.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.17 99.83 6.27 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -179.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -71.1 -56.09 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -168.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.0 p30 -156.27 -168.09 2.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.476 1.51 . . . . 0.0 108.376 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.4 -17.1 58.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -117.3 -53.65 2.43 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 121.166 -0.959 . . . . 0.0 109.671 -167.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 44.9 m -86.55 138.06 32.02 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.81 0.844 . . . . 0.0 109.48 177.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.5 m -131.65 158.98 43.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 165.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -144.32 170.38 16.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.933 -1.105 . . . . 0.0 109.975 170.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.434 ' CE1' HG21 ' A' ' 44' ' ' VAL . 53.7 p90 -151.93 167.76 27.33 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -128.92 141.08 51.39 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 173.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.4 ttt -140.8 105.67 4.95 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -167.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.1 m -65.79 149.86 49.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.427 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.2 m-85 -55.88 -32.89 64.1 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.5 -7.58 81.98 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 118.572 -1.126 . . . . 0.0 113.362 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -66.87 -49.04 66.92 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.26 2.03 . . . . 0.0 107.958 164.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.36 -46.43 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.197 1.399 . . . . 0.0 108.855 177.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.71 -36.29 80.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.328 0.251 . . . . 0.0 111.397 -176.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.39 -40.69 85.69 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.493 0.717 . . . . 0.0 111.027 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.7 mtp85 -64.07 -14.97 58.4 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.988 -1.005 . . . . 0.0 111.703 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.05 7.19 80.94 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.33 -0.705 . . . . 0.0 113.18 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -80.45 -174.88 4.87 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 166.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -138.79 148.4 43.77 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -59.08 -30.68 68.25 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.595 0.634 . . . . 0.0 112.469 -174.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -82.69 -48.78 10.5 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.33 -36.61 66.44 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.989 0.916 . . . . 0.0 112.919 -171.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -44.29 -54.76 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 124.391 1.076 . . . . 0.0 109.354 170.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -76.95 -11.96 59.88 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -121.76 7.24 9.92 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.695 0.798 . . . . 0.0 112.84 -167.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -136.66 87.04 2.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.473 -2.047 . . . . 0.0 105.473 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -51.12 -38.14 50.13 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 -164.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.28 -32.13 58.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.614 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -79.53 -18.1 52.6 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.286 176.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -48.99 75.54 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 166.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -53.27 -34.74 58.49 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.292 1.437 . . . . 0.0 112.696 -169.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.424 ' H ' ' HG2' ' A' ' 39' ' ' GLU . 2.1 mm-40 -59.26 -32.98 70.5 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.377 1.471 . . . . 0.0 111.315 -178.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.409 HD21 ' CE2' ' A' ' 13' ' ' PHE . 0.0 OUTLIER -58.2 -57.84 11.09 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.418 1.087 . . . . 0.0 108.328 173.174 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HA ' HG22 ' A' ' 44' ' ' VAL . 75.9 m-85 -63.98 -36.73 84.94 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.848 1.259 . . . . 0.0 110.918 -172.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -56.11 -44.23 78.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.778 172.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.23 -41.54 76.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.498 1.045 . . . . 0.0 111.279 -176.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.434 HG21 ' CE1' ' A' ' 13' ' ' PHE . 17.6 m -70.96 -43.21 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 O-C-N 121.217 -0.927 . . . . 0.0 111.389 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 50.5 tpp -56.8 -43.28 80.78 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 123.621 0.768 . . . . 0.0 109.056 172.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.55 -40.26 94.05 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.457 -0.777 . . . . 0.0 111.925 176.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.72 -9.45 9.25 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.604 1.561 . . . . 0.0 112.896 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.451 HG23 ' HG3' ' A' ' 52' ' ' GLU . 22.6 m -128.92 6.21 2.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 C-N-CA 124.614 1.166 . . . . 0.0 111.431 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -26.31 64.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -164.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -60.23 -22.79 63.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.986 0.914 . . . . 0.0 112.209 176.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -103.94 -3.23 25.0 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.167 1.387 . . . . 0.0 111.372 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.451 ' HG3' HG23 ' A' ' 48' ' ' VAL . 77.6 mm-40 -121.61 -14.8 8.11 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.222 1.009 . . . . 0.0 112.097 -169.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.64 -25.59 53.83 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.126 0.876 . . . . 0.0 112.746 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -76.24 -21.45 56.35 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.764 0.826 . . . . 0.0 112.351 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -127.21 -2.35 6.35 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 124.731 1.212 . . . . 0.0 113.646 -162.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.7 p -77.48 64.6 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 123.24 1.495 . . . . 0.0 110.329 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -159.97 35.92 0.18 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.302 1.441 . . . . 0.0 108.877 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.1 -175.93 33.64 Favored Glycine 0 CA--C 1.53 0.993 0 C-N-CA 125.819 1.676 . . . . 0.0 110.377 -173.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.28 172.22 11.5 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 123.53 2.82 . . . . 0.0 111.442 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.4 tp -137.79 150.62 47.36 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 173.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -143.02 147.03 34.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.075 1.35 . . . . 0.0 107.538 -170.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.9 mm -132.18 144.85 35.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -136.22 154.51 50.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.071 1.748 . . . . 0.0 106.612 162.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -140.03 160.38 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 O-C-N 121.014 -1.053 . . . . 0.0 109.801 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -132.76 147.25 52.32 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.862 2.065 . . . . 0.0 105.519 162.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.53 128.47 55.21 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 167.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.429 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -117.76 -172.82 2.31 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.616 2.366 . . . . 0.0 108.021 -169.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.92 -38.58 88.96 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.323 -0.861 . . . . 0.0 113.303 -166.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.4 mmtm -141.34 25.4 2.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.653 1.181 . . . . 0.0 112.298 -179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.54 -169.44 37.93 Favored Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -177.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mp -135.78 144.2 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.457 1.103 . . . . 0.0 108.437 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.429 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 26.1 mt-10 -92.61 140.6 29.38 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 160.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.403 HD12 ' C ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -128.47 127.9 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 N-CA-C 104.443 -2.428 . . . . 0.0 104.443 175.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -108.89 143.66 18.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 104.776 -2.305 . . . . 0.0 104.776 176.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.78 131.7 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 -172.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -135.31 167.96 20.07 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.619 0.645 . . . . 0.0 110.206 -167.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -143.4 169.19 18.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.492 1.917 . . . . 0.0 107.726 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.25 163.87 4.67 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 162.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -77.99 61.39 2.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.35 1.06 . . . . 0.0 110.502 177.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 61.0 tp -57.14 -31.02 64.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.46 1.504 . . . . 0.0 111.819 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.8 m -121.15 39.86 3.71 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.596 1.558 . . . . 0.0 109.845 -173.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -51.67 -35.62 43.18 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.364 1.066 . . . . 0.0 110.603 172.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.9 t0 -128.53 153.25 47.38 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.449 1.5 . . . . 0.0 107.144 164.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.4 tp -157.45 -37.28 0.07 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.164 0.986 . . . . 0.0 111.171 -172.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.59 -32.66 71.54 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -92.38 162.88 14.08 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.826 0.822 . . . . 0.0 111.31 -175.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -155.18 138.28 15.57 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -155.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.9 m -138.0 160.38 64.68 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.279 1.432 . . . . 0.0 108.841 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.3 156.98 12.31 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 124.059 3.173 . . . . 0.0 113.312 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 . . . . . 0 C--O 1.254 1.303 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.352 170.238 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 111.412 0.153 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -130.28 130.49 44.6 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 125.33 1.452 . . . . 0.0 107.154 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 mm -123.63 151.22 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 120.175 1.352 . . . . 0.0 108.889 -170.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -143.37 151.2 40.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.703 1.601 . . . . 0.0 109.484 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.12 93.5 3.83 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm -66.2 -54.46 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -170.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -155.72 -160.81 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.538 1.535 . . . . 0.0 108.706 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -72.13 -10.96 60.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -175.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -130.74 -40.81 1.2 Allowed 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.273 -0.892 . . . . 0.0 111.686 -166.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 35.7 m -91.65 132.51 36.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 170.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.5 m -135.99 155.94 36.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 164.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.2 pttt -140.4 168.78 18.99 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.29 -0.882 . . . . 0.0 109.82 176.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -149.56 164.67 34.45 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 175.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -125.69 141.21 52.13 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 173.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.7 ttt -139.65 104.95 5.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -167.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -67.04 148.96 51.26 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.5 m-85 -51.83 -42.12 62.31 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -73.51 -11.88 80.21 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.412 -1.216 . . . . 0.0 113.842 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -64.9 -41.33 95.69 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.905 1.852 . . . . 0.0 109.214 166.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.3 mt -71.65 -40.98 71.32 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.179 1.391 . . . . 0.0 108.177 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.52 -35.67 80.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.156 0.435 . . . . 0.0 111.655 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -65.08 -40.46 94.65 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.91 0.862 . . . . 0.0 111.188 -175.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 56.8 mtt-85 -67.02 -15.18 63.56 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.847 1.259 . . . . 0.0 110.783 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.09 11.18 82.82 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.893 1.235 . . . . 0.0 113.055 -176.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -83.7 -175.31 5.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 170.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -139.04 153.96 48.16 Favored 'General case' 0 CA--C 1.519 -0.231 0 O-C-N 121.247 -0.908 . . . . 0.0 108.566 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.9 ptt-85 -60.74 -29.29 69.3 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.755 1.222 . . . . 0.0 113.611 -172.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -90.6 -42.85 10.55 Favored 'General case' 0 C--O 1.226 -0.17 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -59.04 -34.41 71.89 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.193 0.997 . . . . 0.0 112.776 -174.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.6 mm -42.25 -58.29 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.532 1.133 . . . . 0.0 109.364 167.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -73.04 -33.3 65.63 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.456 0.702 . . . . 0.0 112.235 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -96.2 4.84 52.13 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -168.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -128.38 88.51 2.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 171.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -50.06 -42.9 50.77 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -167.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -30.35 64.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.554 -0.716 . . . . 0.0 111.121 -178.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -79.95 -17.55 52.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.214 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -48.8 76.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 167.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.55 -34.95 62.69 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.216 1.406 . . . . 0.0 112.408 -169.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.06 -34.73 68.55 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.897 1.279 . . . . 0.0 111.525 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -54.71 43.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.492 1.117 . . . . 0.0 108.245 175.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -66.28 -37.7 86.08 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.482 1.113 . . . . 0.0 110.665 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -57.75 -36.75 72.53 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 117.913 -1.041 . . . . 0.0 112.098 172.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -68.56 -42.92 77.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 120.524 1.511 . . . . 0.0 110.629 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 m -73.01 -41.31 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 121.167 -0.958 . . . . 0.0 111.075 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.2 mmt -59.2 -41.86 89.52 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.38 0.672 . . . . 0.0 110.38 170.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.89 -42.95 98.99 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.576 0.625 . . . . 0.0 111.229 176.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -8.3 15.17 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.554 1.541 . . . . 0.0 112.031 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.53 -3.82 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.441 1.896 . . . . 0.0 109.566 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -56.71 -28.29 60.69 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -163.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.15 -15.09 59.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.474 1.034 . . . . 0.0 113.047 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -118.68 -31.45 4.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.592 1.157 . . . . 0.0 111.162 169.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -57.44 -26.65 61.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.078 -1.014 . . . . 0.0 111.316 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.87 -15.56 8.94 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.817 1.19 . . . . 0.0 113.703 175.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -122.59 13.91 10.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.542 1.137 . . . . 0.0 111.721 174.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.34 -1.7 8.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.79 1.236 . . . . 0.0 112.385 171.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.0 p -75.97 68.22 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 124.848 1.259 . . . . 0.0 110.091 167.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -152.96 27.63 0.53 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.162 0.985 . . . . 0.0 110.554 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.73 178.73 46.41 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.975 1.274 . . . . 0.0 110.579 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.45 174.15 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.587 0 C-N-CA 124.113 3.209 . . . . 0.0 111.818 -178.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -128.37 152.58 48.01 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.873 1.269 . . . . 0.0 107.776 170.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -140.17 151.22 45.07 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.304 1.842 . . . . 0.0 106.939 -172.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.3 mm -134.27 144.12 36.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.949 0.795 . . . . 0.0 109.046 -172.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -137.49 155.6 49.1 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.609 1.963 . . . . 0.0 107.066 164.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.9 p -147.92 156.48 9.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 120.435 -1.415 . . . . 0.0 110.036 -172.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -132.03 145.77 51.65 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 164.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -105.49 132.43 51.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.8 mp -120.15 -177.56 3.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.931 2.493 . . . . 0.0 107.97 -170.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.87 -36.52 79.42 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -164.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 45.8 mmtm -141.63 27.79 1.84 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.405 1.082 . . . . 0.0 112.01 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.66 -171.99 40.08 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -174.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.86 144.51 41.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.897 1.279 . . . . 0.0 108.384 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -94.52 137.35 33.75 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 161.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -126.52 125.43 67.24 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 N-CA-C 104.993 -2.225 . . . . 0.0 104.993 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.5 142.71 18.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.3 m -132.47 147.13 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 118.475 0.579 . . . . 0.0 109.761 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.26 170.19 16.46 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.173 0.989 . . . . 0.0 110.01 -164.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -134.57 160.9 36.63 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 124.099 0.96 . . . . 0.0 111.225 171.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.03 -21.85 46.3 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.196 -1.365 . . . . 0.0 112.258 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -62.23 -21.94 65.55 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.786 0.834 . . . . 0.0 112.492 -175.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.52 -27.92 66.61 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.448 1.099 . . . . 0.0 112.43 171.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 m -134.88 33.21 3.18 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.689 0.796 . . . . 0.0 112.138 -156.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -56.79 -31.92 65.14 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.711 -0.618 . . . . 0.0 111.749 175.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -144.72 -34.48 0.36 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.529 0.732 . . . . 0.0 111.542 174.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.0 tp 75.32 -28.28 0.19 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 128.34 2.656 . . . . 0.0 113.54 161.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -67.88 -20.32 65.11 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.318 0.647 . . . . 0.0 111.872 167.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.69 155.31 26.75 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.862 -0.524 . . . . 0.0 110.89 174.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.2 tp -146.34 155.69 42.8 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.04 0.936 . . . . 0.0 110.22 -166.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.8 m -63.49 160.12 45.39 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 123.272 0.629 . . . . 0.0 110.381 171.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.44 159.22 8.68 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.943 3.095 . . . . 0.0 113.167 173.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.498 1.919 . . . . 0.0 106.328 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -124.55 75.71 1.43 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -155.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 mm -65.92 153.04 8.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 125.053 1.341 . . . . 0.0 110.106 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -141.11 151.41 43.92 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.02 1.728 . . . . 0.0 110.118 170.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -114.69 89.85 3.2 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.067 1.747 . . . . 0.0 106.502 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.5 mm -59.49 -53.28 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 34.6 p-10 -154.13 -166.16 2.29 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.778 2.031 . . . . 0.0 106.413 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.33 0.34 25.88 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 120.937 -1.102 . . . . 0.0 113.337 -174.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -126.59 -53.82 1.45 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 124.337 1.055 . . . . 0.0 110.051 -169.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.1 m -80.48 135.88 36.21 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 169.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.3 m -128.9 156.75 41.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 163.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.5 pttt -136.13 170.98 15.15 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 168.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.32 150.95 32.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -101.29 145.81 28.37 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 164.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.2 ttt -141.29 105.45 4.8 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 124.488 1.115 . . . . 0.0 108.195 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -66.4 150.72 48.48 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.479 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.9 m-85 -53.01 -42.63 65.81 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.11 -9.39 84.0 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 119.804 -1.189 . . . . 0.0 113.488 -175.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -66.46 -45.14 80.73 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.796 1.798 . . . . 0.0 108.854 165.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 23.0 mt -65.34 -42.15 93.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 C-N-CA 124.959 1.304 . . . . 0.0 107.706 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -62.73 -38.84 92.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.412 0.551 . . . . 0.0 111.627 175.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.37 -42.56 83.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.376 0.67 . . . . 0.0 110.574 -177.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.4 mtt85 -67.09 -7.96 26.99 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 124.14 0.976 . . . . 0.0 112.019 170.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.66 8.37 86.12 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.075 0.845 . . . . 0.0 113.058 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -85.7 -171.11 3.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 168.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -143.2 153.96 43.37 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 172.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -62.29 -33.34 74.45 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -167.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.13 -43.27 13.19 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -57.46 -35.26 69.92 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.088 0.955 . . . . 0.0 112.749 -172.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -42.61 -56.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.33 1.052 . . . . 0.0 109.475 168.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -77.04 -14.87 59.77 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.274 1.03 . . . . 0.0 113.681 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -118.66 7.09 11.63 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.874 0.87 . . . . 0.0 112.429 -167.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -130.09 86.65 2.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -50.23 -40.07 46.41 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -165.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -30.73 59.92 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.719 -0.613 . . . . 0.0 111.324 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -79.78 -16.73 54.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.296 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.94 -48.19 79.99 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 168.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -54.8 -33.73 61.85 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.212 1.405 . . . . 0.0 112.457 -170.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.36 -35.34 71.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.679 1.192 . . . . 0.0 111.277 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -55.84 29.19 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.406 ' HA ' HG22 ' A' ' 44' ' ' VAL . 67.6 m-85 -63.9 -36.48 84.08 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.468 1.107 . . . . 0.0 110.518 -175.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 72.1 m95 -61.21 -40.02 92.41 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.272 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -69.37 -38.13 77.91 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.666 1.575 . . . . 0.0 111.099 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' A' ' 41' ' ' PHE . 18.6 m -74.15 -40.54 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 121.03 -1.044 . . . . 0.0 111.737 178.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.1 tpp -60.79 -39.51 89.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.02 172.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.63 -38.93 75.84 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.698 1.135 . . . . 0.0 111.638 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.3 -8.07 5.29 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.421 1.488 . . . . 0.0 113.478 174.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.0 t -129.58 -10.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 125.596 1.558 . . . . 0.0 110.879 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.98 -29.83 68.71 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -158.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.92 -16.72 45.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.766 0.712 . . . . 0.0 112.571 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -113.43 8.48 17.89 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.188 1.795 . . . . 0.0 110.893 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -131.4 -17.14 2.99 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 125.138 1.375 . . . . 0.0 111.896 -173.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.68 -16.87 18.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -108.73 5.93 25.2 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.953 1.701 . . . . 0.0 112.006 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.54 -3.89 2.96 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.515 1.526 . . . . 0.0 112.776 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.73 67.24 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 123.156 1.455 . . . . 0.0 110.125 169.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -161.33 39.09 0.14 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.612 1.565 . . . . 0.0 108.141 -171.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.68 -174.63 27.63 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 125.727 1.632 . . . . 0.0 110.245 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.27 174.34 9.23 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.7 2.933 . . . . 0.0 111.509 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.4 tp -145.66 147.76 32.34 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.868 1.267 . . . . 0.0 108.064 173.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 93.5 m95 -144.13 147.15 33.33 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.022 1.329 . . . . 0.0 107.807 -175.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.471 HG23 HG12 ' A' ' 75' ' ' VAL . 3.7 mm -139.56 140.86 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -173.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -144.26 169.52 17.73 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.621 1.168 . . . . 0.0 109.583 161.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.2 p -146.65 162.45 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.173 -0.955 . . . . 0.0 109.955 -169.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -133.86 148.07 51.24 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 126.685 1.994 . . . . 0.0 105.631 161.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.38 129.2 55.54 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 166.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.6 mp -119.47 -177.55 3.4 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.557 2.343 . . . . 0.0 108.1 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.66 -35.95 79.43 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -165.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.479 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.2 mmtm -140.96 26.3 2.06 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.478 1.111 . . . . 0.0 112.073 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.26 -171.42 39.25 Favored Glycine 0 C--O 1.228 -0.22 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 -174.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mp -137.59 144.96 42.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 125.186 1.394 . . . . 0.0 108.111 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -96.43 140.39 31.15 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 161.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -126.76 128.08 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -116.57 134.45 60.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 104.078 -2.564 . . . . 0.0 104.078 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.471 HG12 HG23 ' A' ' 62' ' ' ILE . 3.1 m -131.68 135.04 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 177.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.8 p -127.56 159.46 34.55 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -161.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -150.17 158.57 44.3 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.025 1.33 . . . . 0.0 108.047 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.29 161.35 16.88 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 163.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -60.88 149.05 37.41 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 171.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.7 tt -139.23 106.36 5.47 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.7 p -66.17 -46.37 77.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.214 1.406 . . . . 0.0 111.782 -177.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.1 tptt 64.66 -41.92 0.29 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.965 2.506 . . . . 0.0 112.374 -166.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.41 141.87 21.66 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 125.977 1.711 . . . . 0.0 107.528 166.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.2 tp -161.0 -41.52 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.676 0.79 . . . . 0.0 110.838 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.33 -34.21 76.86 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -171.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -66.34 141.17 58.07 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.773 0.321 . . . . 0.0 110.455 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.64 160.23 30.53 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.9 m -138.03 157.12 73.61 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.298 1.439 . . . . 0.0 108.068 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -84.42 24.89 0.72 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 124.296 3.331 . . . . 0.0 113.401 -170.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 124.26 1.024 . . . . 0.0 109.095 175.344 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.398 0.142 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -138.12 117.52 12.85 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -162.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 mp -112.76 152.92 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 120.649 1.568 . . . . 0.0 108.223 -177.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -137.17 150.58 48.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.387 1.875 . . . . 0.0 109.239 172.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.25 106.3 15.67 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 173.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 38.4 mm -70.69 -54.77 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -179.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 p30 -159.11 -168.19 2.28 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.631 1.572 . . . . 0.0 108.665 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -60.29 -15.77 28.24 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.799 1.24 . . . . 0.0 113.475 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -125.57 -46.64 1.73 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.174 -0.953 . . . . 0.0 111.785 -168.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 84.3 m -87.45 141.5 28.58 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.2 m -128.66 157.57 41.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 164.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 39.0 pttt -133.81 166.57 22.36 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 164.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.462 ' CE1' HG21 ' A' ' 44' ' ' VAL . 46.7 p90 -151.96 170.8 18.99 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -132.77 136.39 46.3 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -129.76 114.36 15.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 -171.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.0 m -73.97 154.63 39.24 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.477 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 21.1 m-85 -55.48 -39.02 69.89 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.389 -0.819 . . . . 0.0 111.58 173.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.34 -25.7 72.52 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-O 119.119 -0.823 . . . . 0.0 113.126 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -37.23 81.69 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.402 1.601 . . . . 0.0 109.736 174.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 71.1 mt -73.74 -43.18 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.07 -39.95 87.82 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.809 1.244 . . . . 0.0 111.7 176.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.89 -42.36 99.75 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.698 0.799 . . . . 0.0 111.145 -177.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.3 mtt85 -68.19 -12.17 60.5 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.37 173.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.79 12.57 84.05 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.799 1.19 . . . . 0.0 112.829 -177.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -82.02 -177.72 6.72 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 168.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.418 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 9.5 t70 -132.19 146.89 52.33 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.624 -1.251 . . . . 0.0 107.624 173.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -57.11 -30.37 64.32 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.366 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -82.85 -50.05 9.04 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.933 0.788 . . . . 0.0 109.169 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.1 mm-40 -55.9 -36.0 67.17 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.228 1.011 . . . . 0.0 112.671 -171.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.8 mm -42.72 -56.55 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.587 1.155 . . . . 0.0 109.524 169.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -76.04 -13.78 60.22 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -118.38 7.75 12.02 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.585 0.754 . . . . 0.0 112.32 -167.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -137.62 88.25 2.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.04 -2.207 . . . . 0.0 105.04 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -49.85 -42.86 48.38 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -165.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 -32.25 65.59 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 121.594 -0.691 . . . . 0.0 111.016 -178.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -77.56 -18.84 56.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.072 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -55.44 24.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 165.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -52.14 -33.96 42.42 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.498 1.519 . . . . 0.0 113.171 -166.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.426 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 1.8 mm-40 -54.52 -40.59 68.75 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.47 1.108 . . . . 0.0 111.264 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' O ' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -60.21 -51.29 70.22 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.173 0.989 . . . . 0.0 109.576 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -65.55 -34.61 78.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.019 0.927 . . . . 0.0 110.131 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -62.08 -36.58 82.1 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.613 -1.184 . . . . 0.0 112.446 172.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.36 -46.63 82.58 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 121.082 1.765 . . . . 0.0 110.856 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 13' ' ' PHE . 15.7 m -70.51 -41.49 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 121.78 -0.575 . . . . 0.0 110.762 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 35.9 tpp -59.68 -41.86 91.64 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.451 0.7 . . . . 0.0 109.715 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -62.02 -42.16 98.87 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.411 -0.805 . . . . 0.0 111.37 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -64.6 -8.43 14.19 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 126.328 1.851 . . . . 0.0 112.211 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.9 m -125.92 4.08 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.761 1.224 . . . . 0.0 111.907 175.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.47 -25.48 66.06 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -163.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -61.46 -23.25 65.73 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.451 1.023 . . . . 0.0 111.78 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -90.89 -7.59 51.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.584 1.154 . . . . 0.0 111.492 177.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.57 -23.59 2.32 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -157.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -59.34 -27.27 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.52 1.055 . . . . 0.0 112.539 -176.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -79.45 -10.51 59.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.164 0.985 . . . . 0.0 112.376 176.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -131.97 -10.67 3.4 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.461 1.105 . . . . 0.0 113.82 -163.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.8 m -72.59 3.56 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.73 1.605 . . . . 0.0 113.714 176.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -58.01 -21.21 43.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.426 1.09 . . . . 0.0 113.302 156.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.76 -175.89 38.31 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.889 1.233 . . . . 0.0 112.191 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -72.53 171.24 17.53 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 112.154 -175.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 28.6 tp -142.26 152.11 42.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.506 1.522 . . . . 0.0 106.936 166.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -142.65 152.06 42.07 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.884 1.674 . . . . 0.0 107.087 -173.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mm -135.18 142.35 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -172.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -139.61 153.7 47.41 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.57 2.348 . . . . 0.0 106.36 170.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.7 p -139.81 160.95 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 121.048 -1.032 . . . . 0.0 109.217 -178.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -133.92 148.06 51.16 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 161.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.81 128.27 55.7 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.404 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.9 mp -119.22 -175.06 2.85 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.482 2.313 . . . . 0.0 107.939 -169.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -62.92 -36.75 84.43 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -165.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 47.6 mmtm -141.56 25.02 2.04 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.524 1.13 . . . . 0.0 112.4 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -175.63 -170.72 38.82 Favored Glycine 0 CA--C 1.518 0.27 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -176.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 mp -136.9 144.57 43.56 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.061 1.344 . . . . 0.0 108.368 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.404 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 32.2 mt-10 -93.04 145.87 24.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 160.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.71 129.81 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 176.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.58 137.63 49.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 104.03 -2.582 . . . . 0.0 104.03 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.82 134.78 55.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 119.249 0.931 . . . . 0.0 109.452 175.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.3 p -131.61 176.14 8.57 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.16 0.984 . . . . 0.0 110.391 -157.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -135.19 -178.11 4.95 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.645 1.578 . . . . 0.0 111.148 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -134.18 169.36 17.3 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 126.73 2.012 . . . . 0.0 108.706 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -139.59 162.62 34.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.146 1.378 . . . . 0.0 108.351 174.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.1 tp -143.77 40.3 1.4 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.504 1.122 . . . . 0.0 109.054 -176.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.9 p -62.23 -12.09 18.4 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -60.46 -24.75 65.49 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 120.475 -1.391 . . . . 0.0 111.999 167.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -76.27 -4.97 44.88 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.413 1.006 . . . . 0.0 112.451 173.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 tt -104.54 -50.09 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.579 1.551 . . . . 0.0 107.612 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.68 -32.73 69.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.979 1.312 . . . . 0.0 111.983 173.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.1 tptt 58.5 175.63 0.06 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.028 2.531 . . . . 0.0 113.702 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.04 163.05 28.38 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.851 0.86 . . . . 0.0 108.868 173.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.61 158.13 73.8 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.135 1.374 . . . . 0.0 108.164 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -84.98 29.97 0.53 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.5 3.467 . . . . 0.0 112.493 -171.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 126.632 1.973 . . . . 0.0 108.554 -171.761 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -140.05 85.85 2.05 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -150.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 mm -72.35 152.11 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 124.003 0.921 . . . . 0.0 109.357 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -141.98 151.8 42.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.716 1.607 . . . . 0.0 110.178 170.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 tpp85 -113.73 102.43 10.24 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.7 mm -69.04 -53.69 24.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -159.73 -166.6 1.79 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.888 1.675 . . . . 0.0 108.694 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.73 -16.38 60.97 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -126.19 -26.53 3.36 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.643 1.177 . . . . 0.0 112.725 -164.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 73.4 m -115.21 134.76 54.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.553 1.141 . . . . 0.0 108.241 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.6 m -122.44 157.57 27.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 166.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -134.76 168.09 19.66 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 162.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.462 ' CE1' HG21 ' A' ' 44' ' ' VAL . 41.0 p90 -149.77 162.51 40.13 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -117.45 126.76 53.18 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 171.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 5.8 ttt -115.98 108.26 16.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 125.37 1.468 . . . . 0.0 108.02 -177.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.18 147.89 51.63 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.736 171.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.2 m-85 -51.35 -39.33 56.83 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -65.27 -25.17 71.03 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 118.729 -1.04 . . . . 0.0 113.237 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -70.93 -38.58 72.92 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.773 1.787 . . . . 0.0 110.822 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 56.1 mt -64.47 -47.27 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -58.93 -43.49 91.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.349 1.459 . . . . 0.0 111.858 174.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.68 -44.98 94.86 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.928 0.891 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -68.62 -5.29 19.17 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.018 0.927 . . . . 0.0 111.733 172.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.75 12.47 84.47 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 124.502 1.049 . . . . 0.0 112.87 175.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -78.58 -175.08 4.15 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 163.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.428 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 8.1 t70 -133.42 144.08 49.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 106.422 -1.696 . . . . 0.0 106.422 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.6 ptt180 -55.36 -33.51 63.47 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.785 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -77.06 -49.43 15.35 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.778 0.717 . . . . 0.0 109.411 175.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.428 ' H ' ' HB3' ' A' ' 26' ' ' ASP . 5.5 mm-40 -59.76 -34.92 73.61 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.973 0.909 . . . . 0.0 112.146 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.0 mm -49.94 -52.0 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 C-N-CA 123.521 0.729 . . . . 0.0 109.566 171.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -65.73 -36.97 85.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.045 0.839 . . . . 0.0 111.243 -177.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -101.29 1.65 38.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -160.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -135.65 91.46 2.71 Favored 'General case' 0 CA--C 1.524 -0.056 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 -178.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -59.59 -50.78 72.54 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -160.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -31.52 64.72 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 174.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -80.55 -18.51 48.17 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.52 175.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.96 -52.16 64.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 165.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -52.18 -34.09 43.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.359 1.463 . . . . 0.0 113.098 -168.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -57.52 -37.47 73.06 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.356 1.063 . . . . 0.0 111.646 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -56.25 24.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.761 0.824 . . . . 0.0 108.92 176.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -62.14 -35.1 77.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.732 0.813 . . . . 0.0 109.888 -176.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 63.9 m95 -65.09 -34.81 79.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.787 -1.101 . . . . 0.0 112.907 171.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -71.27 -35.62 71.43 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 121.099 1.772 . . . . 0.0 111.277 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 13' ' ' PHE . 16.7 m -75.02 -36.8 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 121.118 -0.989 . . . . 0.0 111.779 176.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -46.0 80.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 118.986 -0.53 . . . . 0.0 110.255 165.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.67 -34.94 73.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.697 0.681 . . . . 0.0 112.316 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.47 -17.08 11.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.695 1.198 . . . . 0.0 112.578 173.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 30.5 m -134.78 11.67 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.592 1.557 . . . . 0.0 112.46 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.07 -26.65 39.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.526 1.131 . . . . 0.0 113.129 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.63 -22.36 66.36 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 173.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -104.6 -39.83 6.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.668 1.187 . . . . 0.0 110.165 173.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -65.71 -21.23 66.51 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.258 -0.877 . . . . 0.0 112.177 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -58.38 -19.98 40.28 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.912 1.687 . . . . 0.0 112.384 171.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -99.7 6.22 45.61 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.415 1.486 . . . . 0.0 111.291 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.82 -4.86 1.05 Allowed 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -173.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -88.12 1.05 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 121.314 1.87 . . . . 0.0 112.397 169.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -57.35 -12.75 2.69 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.217 1.007 . . . . 0.0 112.783 149.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -130.1 -178.21 15.29 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.994 1.759 . . . . 0.0 110.695 176.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.02 177.46 7.73 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.526 2.818 . . . . 0.0 113.172 -166.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.0 tp -141.42 149.63 41.29 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.417 1.487 . . . . 0.0 107.009 166.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -145.1 151.22 38.15 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.255 1.422 . . . . 0.0 107.582 -171.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.6 mm -133.26 144.07 37.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -170.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -140.58 149.94 43.01 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.827 1.651 . . . . 0.0 107.135 163.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.6 155.92 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 120.755 -1.216 . . . . 0.0 110.143 -173.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.71 150.47 36.33 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 161.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.92 148.62 26.14 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 167.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 mp -128.89 -177.06 4.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.354 2.662 . . . . 0.0 108.319 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.6 -32.52 73.55 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -169.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.448 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.1 mmtm -138.33 19.39 2.76 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.324 1.049 . . . . 0.0 112.663 -176.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 177.5 -164.98 34.46 Favored Glycine 0 C--O 1.225 -0.422 0 O-C-N 121.119 -0.988 . . . . 0.0 111.144 -175.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.5 mp -131.42 145.87 52.0 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.748 1.619 . . . . 0.0 107.264 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -103.19 130.83 50.5 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 160.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 mp -118.38 128.09 75.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 105.032 -2.211 . . . . 0.0 105.032 178.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.7 mp -104.41 144.51 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 168.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.87 127.64 40.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -176.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -131.74 170.59 14.6 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 118.902 0.774 . . . . 0.0 111.535 -163.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -131.31 165.04 24.31 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.991 1.317 . . . . 0.0 109.545 163.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.03 139.31 54.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.023 -175.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -145.85 161.9 38.93 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.305 1.842 . . . . 0.0 107.245 166.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -128.74 156.08 44.09 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.808 1.243 . . . . 0.0 108.221 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.3 m 50.92 36.89 16.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.387 1.475 . . . . 0.0 113.631 171.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -55.06 -47.48 74.79 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.561 -0.712 . . . . 0.0 111.062 -171.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -69.47 -4.69 19.79 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.454 1.101 . . . . 0.0 113.244 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.0 mt -125.97 -21.5 4.33 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.711 1.205 . . . . 0.0 111.593 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -132.46 -24.39 2.03 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.974 0.91 . . . . 0.0 112.639 -176.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -112.86 1.67 15.61 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.62 163.45 1.82 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.1 0.56 . . . . 0.0 110.933 162.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.7 m -137.15 158.11 73.17 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.791 1.237 . . . . 0.0 108.263 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -85.58 31.03 0.49 Allowed 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 124.454 3.436 . . . . 0.0 112.491 -173.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.582 1.953 . . . . 0.0 108.393 -172.615 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 ptm . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.61 72.84 1.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.035 1.334 . . . . 0.0 107.959 -166.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 mm -62.03 151.88 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 124.923 1.289 . . . . 0.0 109.468 175.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -147.67 127.24 13.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.855 1.262 . . . . 0.0 110.147 172.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp85 -82.22 110.38 17.36 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 173.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.467 HD11 ' HG2' ' A' ' 12' ' ' LYS . 21.0 mm -74.53 -55.71 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -156.86 -165.19 1.79 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.406 1.483 . . . . 0.0 108.643 -177.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.68 -20.86 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.14 0.976 . . . . 0.0 113.474 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -124.67 -42.3 2.08 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.966 0.906 . . . . 0.0 111.613 -166.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 55.6 m -92.2 137.85 32.02 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.9 m -127.07 155.77 38.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 166.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.467 ' HG2' HD11 ' A' ' 6' ' ' ILE . 42.6 pttt -129.73 171.57 12.53 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 165.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -151.42 152.42 33.04 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -105.56 142.51 35.18 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 166.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.9 ttt -138.24 104.75 5.28 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 125.017 1.327 . . . . 0.0 108.063 -172.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -67.06 154.07 42.12 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 22.3 m-85 -51.61 -33.35 32.6 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -85.23 -11.2 76.26 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 119.897 -1.144 . . . . 0.0 113.41 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -68.69 -40.54 80.03 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.702 1.751 . . . . 0.0 108.846 166.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.4 mt -64.12 -46.38 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.162 1.385 . . . . 0.0 108.698 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.71 -35.3 80.36 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.47 0.308 . . . . 0.0 111.346 -177.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.33 -43.38 98.95 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.362 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.1 mtt-85 -69.35 -7.08 34.15 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.355 1.062 . . . . 0.0 111.455 174.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.62 84.6 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.412 1.006 . . . . 0.0 112.731 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -83.89 -175.13 5.66 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -141.56 148.7 39.73 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -57.01 -36.64 70.66 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.142 0.883 . . . . 0.0 111.397 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -76.06 -45.06 36.1 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -61.05 -37.06 81.27 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.256 -0.902 . . . . 0.0 111.866 -173.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.9 mm -54.71 -44.81 72.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 124.146 0.978 . . . . 0.0 110.126 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -69.79 -26.48 64.29 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -120.98 8.73 10.47 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -157.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -131.48 100.59 5.2 Favored 'General case' 0 N--CA 1.458 -0.057 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -58.18 -16.69 14.48 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -165.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.34 -31.09 6.69 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.53 1.532 . . . . 0.0 111.777 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -77.71 -18.0 57.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.232 0.924 . . . . 0.0 111.124 176.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.3 p -54.39 -55.18 31.24 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.932 0.893 . . . . 0.0 109.329 165.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -56.89 -31.3 64.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.376 1.87 . . . . 0.0 112.865 -169.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -58.94 -36.13 74.28 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.453 1.101 . . . . 0.0 111.109 -177.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -55.69 29.04 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -62.82 -36.1 82.09 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.095 0.958 . . . . 0.0 109.809 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -62.15 -38.81 90.4 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.765 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.66 -34.74 77.54 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.39 1.45 . . . . 0.0 110.698 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.8 m -77.59 -39.44 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 120.921 -1.112 . . . . 0.0 111.795 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -42.6 77.03 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.846 -0.533 . . . . 0.0 110.098 169.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -59.44 -40.18 85.96 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.051 0.541 . . . . 0.0 111.849 175.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -60.8 -11.23 7.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.903 1.281 . . . . 0.0 112.936 173.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -123.04 5.11 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.304 1.842 . . . . 0.0 109.571 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -57.14 -31.9 65.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.245 -1.534 . . . . 0.0 114.031 -166.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.15 -12.75 42.88 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -114.95 -37.28 4.2 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.765 1.626 . . . . 0.0 110.318 175.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -58.66 -29.32 66.49 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.491 -0.755 . . . . 0.0 110.948 174.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -59.18 -13.29 6.92 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.112 1.324 . . . . 0.0 113.863 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -124.86 14.85 8.6 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.665 1.186 . . . . 0.0 111.829 173.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -128.76 -4.16 5.23 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.696 1.198 . . . . 0.0 112.973 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 12.4 p -78.83 62.11 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 123.362 1.553 . . . . 0.0 110.858 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -159.48 32.37 0.2 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.8 1.24 . . . . 0.0 109.314 -168.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.48 -177.16 38.22 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 125.753 1.644 . . . . 0.0 109.795 -177.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.6 170.89 16.5 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.294 2.663 . . . . 0.0 111.377 -179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.39 148.41 46.18 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -138.24 148.52 44.83 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 3.6 mm -139.34 141.41 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -143.78 161.78 37.74 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.664 0.786 . . . . 0.0 109.461 156.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.4 p -152.23 157.76 4.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 O-C-N 121.203 -0.936 . . . . 0.0 109.868 -171.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -144.74 149.56 35.75 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 162.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.41 146.97 32.52 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 165.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 mp -128.07 -179.18 4.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.103 2.561 . . . . 0.0 108.163 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -62.08 -31.06 71.46 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -166.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 46.3 mmtm -140.39 22.0 2.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.25 1.02 . . . . 0.0 112.197 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -177.92 -168.79 37.99 Favored Glycine 0 CA--C 1.519 0.323 0 O-C-N 121.059 -1.026 . . . . 0.0 111.275 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.0 mp -132.38 146.38 51.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 125.793 1.637 . . . . 0.0 107.703 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.81 131.29 52.47 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 160.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 mp -116.15 135.07 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.819 -2.289 . . . . 0.0 104.819 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.5 mp -111.82 141.96 25.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 165.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.92 144.06 37.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.49 161.71 34.28 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -161.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.3 mppt? -143.31 163.96 31.56 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.973 1.709 . . . . 0.0 108.027 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -137.78 28.56 2.65 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.521 1.128 . . . . 0.0 110.829 -170.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -93.06 14.2 18.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.696 0.798 . . . . 0.0 112.951 -168.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.0 tp -52.58 -37.18 57.5 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.678 0.791 . . . . 0.0 111.432 178.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.6 m -64.09 1.5 0.69 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.369 1.468 . . . . 0.0 114.183 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -53.3 -29.58 34.17 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.998 -1.064 . . . . 0.0 110.249 162.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -113.52 121.29 43.8 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 164.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.3 tp -160.29 142.68 13.11 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.3 t70 61.45 -21.89 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.826 2.451 . . . . 0.0 115.773 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -62.15 153.62 29.63 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 119.34 0.973 . . . . 0.0 111.016 176.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -66.65 161.09 24.09 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.624 0.77 . . . . 0.0 109.665 174.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.6 m -136.92 161.97 58.5 Favored Pre-proline 0 CA--C 1.545 0.762 0 C-N-CA 125.385 1.474 . . . . 0.0 108.645 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -53.06 156.13 10.39 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.822 3.015 . . . . 0.0 113.401 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.798 1.639 . . . . 0.0 107.748 178.94 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -143.08 128.01 18.39 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 -150.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.6 mm -122.47 150.49 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-N 120.285 1.402 . . . . 0.0 108.675 -168.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.9 151.51 42.72 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.012 1.325 . . . . 0.0 110.032 174.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.91 103.58 11.08 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.8 mm -69.72 -55.14 16.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -157.18 -171.41 3.61 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.038 1.735 . . . . 0.0 108.058 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.07 -13.14 14.83 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.56 1.144 . . . . 0.0 113.593 -175.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -123.04 -52.25 1.87 Allowed 'General case' 0 C--N 1.342 0.252 0 O-C-N 121.048 -1.033 . . . . 0.0 110.851 -171.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 69.0 m -80.93 141.36 34.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -128.81 158.77 41.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.1 pttt -134.84 164.07 28.39 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 164.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -149.85 165.47 32.44 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -124.78 136.62 54.01 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 172.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 7.3 ttt -133.21 116.34 16.09 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.7 m -76.61 156.57 32.62 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.452 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 23.4 m-85 -55.5 -43.61 75.82 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.207 -0.933 . . . . 0.0 111.908 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.38 -9.85 86.59 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-O 118.587 -1.118 . . . . 0.0 113.451 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.7 m-20 -66.02 -36.22 82.67 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 119.883 1.841 . . . . 0.0 109.062 166.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.94 -41.03 31.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.151 1.38 . . . . 0.0 107.672 -178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.88 -37.9 83.78 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.349 0.522 . . . . 0.0 111.502 174.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.67 -42.14 91.68 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.878 0.847 . . . . 0.0 110.895 -177.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.7 mtt85 -68.47 -8.99 45.82 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 114.451 -1.249 . . . . 0.0 111.382 172.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.95 12.98 83.87 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.457 1.027 . . . . 0.0 112.866 177.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.56 -170.74 3.26 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 165.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -142.37 150.92 41.34 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 172.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -60.94 -32.4 71.92 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -169.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -84.84 -42.65 14.89 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -57.86 -36.09 71.85 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 124.092 0.957 . . . . 0.0 112.419 -173.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.2 mm -44.15 -51.55 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 124.703 1.201 . . . . 0.0 110.586 169.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -78.43 -14.28 59.45 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.75 7.82 9.96 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -166.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -125.32 99.1 5.91 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.552 1.541 . . . . 0.0 106.958 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -54.82 -20.57 8.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.732 1.613 . . . . 0.0 115.068 -169.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.87 -30.62 9.26 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.963 0.801 . . . . 0.0 112.02 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -78.49 -16.7 57.24 Favored 'General case' 0 C--N 1.338 0.079 0 CA-C-N 118.92 0.782 . . . . 0.0 111.281 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 12.9 p -54.06 -58.56 6.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 166.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.39 -31.42 63.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.438 1.895 . . . . 0.0 112.486 -166.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 39' ' ' GLU . 2.9 mm-40 -59.89 -35.22 74.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 111.307 -176.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -56.86 16.28 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 122.301 1.048 . . . . 0.0 108.548 175.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.25 -37.91 89.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.451 1.1 . . . . 0.0 110.395 -174.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -58.63 -37.0 74.96 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.969 172.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -68.52 -43.44 76.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.347 1.431 . . . . 0.0 110.388 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.8 m -71.13 -40.89 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.935 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.7 mmt -58.53 -43.28 89.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 122.802 0.441 . . . . 0.0 110.647 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -60.27 -42.09 94.64 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.584 0.629 . . . . 0.0 111.256 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -64.21 -6.0 5.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.37 1.868 . . . . 0.0 112.161 176.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -126.77 -0.89 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.635 1.974 . . . . 0.0 109.571 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -57.31 -28.83 63.41 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -161.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.13 -22.26 60.59 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.055 0.843 . . . . 0.0 112.415 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -100.43 -0.91 37.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.065 1.346 . . . . 0.0 111.616 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.12 -20.37 3.79 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.276 1.03 . . . . 0.0 111.801 -163.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -59.71 -14.48 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.942 1.297 . . . . 0.0 114.316 -174.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -126.01 18.31 7.82 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.522 1.529 . . . . 0.0 110.486 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -143.24 27.74 1.56 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.143 1.377 . . . . 0.0 112.061 -174.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -113.28 48.52 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 123.098 1.428 . . . . 0.0 107.716 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -122.35 35.48 4.87 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.469 2.308 . . . . 0.0 108.053 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.77 -177.24 37.2 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 126.418 1.961 . . . . 0.0 109.441 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -69.88 170.93 15.56 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.501 2.8 . . . . 0.0 111.943 -176.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.42 152.37 48.31 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 172.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -148.62 145.04 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.367 1.467 . . . . 0.0 107.185 -163.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.7 mm -135.33 145.41 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -133.21 148.51 52.03 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 158.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.3 p -136.22 157.77 37.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 171.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.487 HE22 HD13 ' A' ' 74' ' ' ILE . 1.2 pm0 -146.25 151.57 37.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 159.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -100.01 143.54 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.402 ' CD1' ' H ' ' A' ' 72' ' ' GLU . 4.8 mp -125.78 -171.87 2.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.215 2.606 . . . . 0.0 107.691 -173.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.11 -37.96 84.61 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -166.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.452 ' HA ' ' CE2' ' A' ' 17' ' ' TYR . 48.3 mmtm -141.78 27.45 1.83 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.363 1.065 . . . . 0.0 112.379 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -178.74 -169.07 38.92 Favored Glycine 0 C--O 1.23 -0.139 0 O-C-N 120.929 -1.107 . . . . 0.0 110.478 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mp -135.26 144.35 46.78 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.222 1.009 . . . . 0.0 109.236 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.402 ' H ' ' CD1' ' A' ' 67' ' ' LEU . 30.8 mt-10 -93.2 133.93 35.9 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 161.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.53 132.1 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.487 HD13 HE22 ' A' ' 65' ' ' GLN . 1.4 mp -112.24 143.31 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 170.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.52 136.33 52.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 118.839 0.745 . . . . 0.0 109.365 171.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -129.69 174.98 9.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.182 0.993 . . . . 0.0 110.146 -160.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -135.19 -177.85 4.83 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.239 1.416 . . . . 0.0 110.721 172.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -134.71 163.51 29.61 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.522 1.929 . . . . 0.0 108.254 175.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -147.09 -41.46 0.18 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.107 0.563 . . . . 0.0 111.669 -177.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -149.39 142.15 24.61 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.1 m -68.13 56.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.351 2.26 . . . . 0.0 112.742 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -56.87 -43.15 80.95 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.467 -1.395 . . . . 0.0 110.691 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -77.75 35.63 0.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.318 1.447 . . . . 0.0 111.786 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.6 tt -154.85 -43.38 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.914 2.086 . . . . 0.0 107.6 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.36 -45.8 89.5 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.783 0.833 . . . . 0.0 110.848 168.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -69.62 152.09 45.16 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 168.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.73 149.56 46.44 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -141.27 161.88 50.62 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.613 1.565 . . . . 0.0 108.402 178.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.81 157.05 10.89 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.047 3.165 . . . . 0.0 113.212 174.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.968 1.707 . . . . 0.0 107.749 179.234 . . . . . . . . 0 0 . 1 stop_ save_