data_2kon_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 2kon _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.76 140.62 32.68 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.267 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -83.19 149.85 26.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.0 110.267 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.406 ' N ' ' O ' ' A' ' 9' ' ' TYR . 88.1 t80 -153.54 115.04 4.2 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.409 -0.807 . . . . 0.0 109.327 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.472 HH12 ' CD1' ' A' ' 71' ' ' LEU . 20.7 mtp-105 52.07 30.18 7.22 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 109.921 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.68 -1.87 81.82 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.406 ' O ' ' N ' ' A' ' 6' ' ' TYR . 95.4 m-85 -106.73 141.93 37.19 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.373 -1.075 . . . . 0.0 109.761 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -89.72 146.1 24.74 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.524 -0.735 . . . . 0.0 109.491 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -121.59 136.52 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -119.18 87.68 35.46 Favored Pre-proline 0 N--CA 1.496 1.857 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.11 146.05 95.68 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.524 2.149 . . . . 0.0 112.204 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.54 -167.72 39.37 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -148.48 142.9 26.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.283 -1.127 . . . . 0.0 109.535 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -161.85 150.57 15.48 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -109.09 143.5 38.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.476 -0.765 . . . . 0.0 109.66 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -99.47 139.11 35.61 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 121.529 0.68 . . . . 0.0 109.83 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.26 -20.24 64.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.442 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.92 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.154 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.5 pt -109.63 0.02 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 42.12 39.64 1.44 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.785 -0.572 . . . . 0.0 109.868 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -140.5 161.45 37.7 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.285 -0.885 . . . . 0.0 109.825 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -85.73 130.86 34.45 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.429 0.633 . . . . 0.0 109.854 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.98 146.85 32.58 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.45 -0.781 . . . . 0.0 109.338 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -37.72 111.55 0.1 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 122.571 2.181 . . . . 0.0 112.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -121.57 117.33 26.5 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -142.15 159.0 43.11 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.193 -0.942 . . . . 0.0 109.592 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 53.8 mt -113.6 134.47 54.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.638 -0.664 . . . . 0.0 109.238 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.42 HD12 HG21 ' A' ' 30' ' ' ILE . 94.9 mt -111.92 133.1 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.681 -0.637 . . . . 0.0 109.53 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -127.32 130.63 49.84 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -83.4 138.64 33.41 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.646 0.736 . . . . 0.0 110.326 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.5 t . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.718 -0.614 . . . . 0.0 109.939 -179.777 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.25 151.92 44.11 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.887 1.725 . . . . 0.0 111.882 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 38.6 mm -115.48 100.21 53.33 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.57 136.2 41.13 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 121.897 1.731 . . . . 0.0 112.483 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 p -95.27 134.97 37.45 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.7 p -138.01 167.16 22.36 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -148.89 141.68 15.42 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.178 -0.951 . . . . 0.0 108.929 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.56 86.33 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.88 1.72 . . . . 0.0 112.226 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -176.4 169.5 2.66 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.499 -0.751 . . . . 0.0 108.98 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -130.7 146.91 52.3 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.418 -0.801 . . . . 0.0 109.413 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.505 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 27.9 m-85 -141.81 123.46 15.1 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.356 -0.84 . . . . 0.0 109.589 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.16 -33.25 67.57 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.355 0.598 . . . . 0.0 109.701 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -89.45 133.12 34.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.805 . . . . 0.0 110.538 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -69.57 -36.04 75.91 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.452 0.644 . . . . 0.0 109.476 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.58 91.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.506 -0.746 . . . . 0.0 109.515 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.505 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 58.0 t0 -63.09 -38.01 89.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.378 -0.826 . . . . 0.0 109.051 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.41 -36.64 84.81 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.493 -0.754 . . . . 0.0 109.639 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.53 -49.48 75.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 109.731 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.63 -42.77 95.27 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.272 -0.892 . . . . 0.0 109.444 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.5 t -65.22 -42.78 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.564 -0.71 . . . . 0.0 109.631 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 98.1 p -56.62 -39.39 73.55 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.411 -0.805 . . . . 0.0 109.676 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.406 HD11 HG22 ' A' ' 60' ' ' ILE . 95.1 mt -63.84 -45.29 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 109.296 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.71 82.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.339 -0.851 . . . . 0.0 109.423 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.56 -46.15 76.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.468 -0.77 . . . . 0.0 109.5 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.13 73.99 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.369 -0.832 . . . . 0.0 109.452 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.42 -43.96 95.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.301 -0.874 . . . . 0.0 109.365 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.37 -44.38 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.433 -0.792 . . . . 0.0 110.104 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 32.7 mm -64.17 -44.38 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.157 -0.964 . . . . 0.0 109.404 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 94.7 mt -64.38 -45.66 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.159 -0.963 . . . . 0.0 109.506 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.28 -46.36 77.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.338 -0.852 . . . . 0.0 109.635 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.2 m -63.15 -37.91 89.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.546 -0.721 . . . . 0.0 109.85 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -59.78 -47.9 83.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.631 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.472 ' CD1' HH12 ' A' ' 7' ' ' ARG . 90.6 mt -64.18 -42.8 96.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.348 -0.845 . . . . 0.0 109.871 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 . . . . . 0 N--CA 1.493 1.721 0 O-C-N 121.319 -0.863 . . . . 0.0 110.33 -179.493 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.18 30.55 1.23 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.275 -1.133 . . . . 0.0 109.305 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.15 -35.81 81.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.648 -0.658 . . . . 0.0 109.308 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' A' ' 80' ' ' ASP . 23.1 p-10 -64.69 -31.88 73.3 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.481 -0.762 . . . . 0.0 109.625 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.35 -3.29 57.36 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.326 -0.859 . . . . 0.0 109.471 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.68 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.173 0.511 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.28 140.82 47.67 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.575 -0.703 . . . . 0.0 109.433 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.9 m170 -85.13 154.13 22.23 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.401 -0.812 . . . . 0.0 110.307 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.665 ' HH ' HH12 ' A' ' 7' ' ' ARG . 20.6 t80 -153.3 111.43 3.62 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.328 -0.857 . . . . 0.0 109.044 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.665 HH12 ' HH ' ' A' ' 6' ' ' TYR . 83.8 mtt85 47.41 31.86 2.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.539 -0.726 . . . . 0.0 110.102 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.34 -20.74 47.98 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -85.4 138.42 32.27 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -1.067 . . . . 0.0 110.107 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.31 139.13 31.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.626 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.0 mt -121.29 130.42 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -121.93 87.94 47.31 Favored Pre-proline 0 N--CA 1.496 1.837 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -57.82 144.97 92.56 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 122.697 2.264 . . . . 0.0 112.506 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.91 98.19 0.11 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -49.01 155.82 0.58 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.434 -1.039 . . . . 0.0 110.793 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -154.87 157.87 38.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.39 -0.819 . . . . 0.0 109.051 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -99.96 120.66 40.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.593 -0.692 . . . . 0.0 109.396 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.581 ' NH1' ' HG1' ' A' ' 44' ' ' THR . 84.4 mtp180 -102.04 138.58 38.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.601 -0.687 . . . . 0.0 109.964 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.22 -17.03 58.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.554 -0.716 . . . . 0.0 109.404 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -59.64 -49.54 77.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.222 -0.924 . . . . 0.0 109.652 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 pt -107.9 0.27 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 50.33 34.93 9.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.643 -0.661 . . . . 0.0 109.582 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -140.44 174.42 10.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.366 -0.834 . . . . 0.0 110.217 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -93.72 130.29 39.74 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.534 0.683 . . . . 0.0 109.954 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' O ' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -143.17 155.63 61.68 Favored Pre-proline 0 N--CA 1.492 1.632 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -55.37 110.19 0.52 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.211 1.941 . . . . 0.0 111.85 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -114.68 117.54 31.12 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -132.52 147.94 52.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.581 -0.699 . . . . 0.0 109.534 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -93.3 128.33 39.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.539 -0.726 . . . . 0.0 109.474 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.3 mt -110.01 127.5 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -132.0 133.27 44.26 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.582 -0.699 . . . . 0.0 109.395 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.42 125.6 40.15 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.661 0.744 . . . . 0.0 109.562 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.7 t . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.533 0.682 . . . . 0.0 110.694 -179.338 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.34 153.95 70.11 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.006 1.804 . . . . 0.0 112.272 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.6 mm -122.34 88.87 49.07 Favored Pre-proline 0 N--CA 1.494 1.732 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -55.25 146.6 59.81 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.662 2.241 . . . . 0.0 112.539 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.78 135.79 40.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.569 -0.707 . . . . 0.0 109.587 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.581 ' HG1' ' NH1' ' A' ' 18' ' ' ARG . 32.0 p -136.21 167.93 20.36 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -136.2 136.62 22.94 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.99 86.82 1.06 Allowed 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 121.974 1.783 . . . . 0.0 112.119 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.472 ' O ' ' CG1' ' A' ' 25' ' ' VAL . 8.9 tt0 -168.54 -173.35 1.9 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 109.213 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -133.69 121.17 21.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.609 -0.682 . . . . 0.0 109.26 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.537 ' C ' ' H ' ' A' ' 51' ' ' LEU . 91.8 m-85 -111.79 -36.88 5.31 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.9 t0 58.87 -0.3 0.14 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.775 -0.578 . . . . 0.0 109.925 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.8 mt -118.03 126.67 52.75 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.397 -0.815 . . . . 0.0 109.638 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.95 -42.49 80.85 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.591 -0.693 . . . . 0.0 109.641 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.66 -47.93 83.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.621 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -67.0 -38.76 86.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.75 -40.98 98.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.304 -0.873 . . . . 0.0 109.216 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.87 -44.99 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.874 . . . . 0.0 109.649 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -65.63 -44.57 86.05 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.282 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.0 t -67.87 -41.4 84.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.572 -0.705 . . . . 0.0 109.418 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.4 p -56.63 -41.32 76.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.207 -0.933 . . . . 0.0 109.616 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.34 -45.0 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.055 -1.028 . . . . 0.0 109.509 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.69 -46.04 73.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.375 -0.828 . . . . 0.0 109.96 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.5 m -66.24 -49.58 66.72 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.423 -0.798 . . . . 0.0 109.495 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -45.4 -46.14 13.1 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.679 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.59 -41.87 98.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.424 HG21 HD12 ' A' ' 65' ' ' ILE . 94.4 mt -64.02 -43.93 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.152 -0.968 . . . . 0.0 109.466 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.64 -44.81 96.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -0.928 . . . . 0.0 108.621 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.07 -43.94 97.62 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 O-C-N 121.06 -1.025 . . . . 0.0 108.795 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.93 -41.82 97.53 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.317 -0.864 . . . . 0.0 109.19 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -60.91 -40.91 94.89 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.525 -0.734 . . . . 0.0 109.35 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -58.92 -44.84 91.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.194 -0.941 . . . . 0.0 109.157 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.14 -41.12 97.31 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.494 -0.754 . . . . 0.0 109.045 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 . . . . . 0 C--N 1.304 -1.406 0 O-C-N 121.405 -0.809 . . . . 0.0 109.432 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.61 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -85.26 33.05 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -1.151 . . . . 0.0 108.414 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.624 -0.672 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.9 -45.57 91.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.366 -0.834 . . . . 0.0 109.618 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.54 -41.39 93.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.337 -0.852 . . . . 0.0 109.773 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.021 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 -179.486 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 121.181 0.515 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.61 138.84 51.12 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.72 -0.612 . . . . 0.0 109.594 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -99.6 114.81 28.07 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.393 -0.817 . . . . 0.0 109.531 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -86.72 -75.62 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.432 -0.792 . . . . 0.0 109.66 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -127.2 52.14 1.83 Allowed 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 93.96 -0.41 66.92 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -112.39 140.32 47.22 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.385 -1.068 . . . . 0.0 109.993 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -84.21 145.13 28.51 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.412 HG21 HD11 ' A' ' 11' ' ' ILE . 96.7 mt -120.94 130.2 74.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -127.3 97.75 30.88 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.93 153.79 37.73 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.422 2.082 . . . . 0.0 113.201 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.71 -150.14 8.09 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.52 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 52.7 p-80 -152.67 147.53 26.22 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -1.111 . . . . 0.0 109.428 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.427 ' OE1' ' CZ ' ' A' ' 27' ' ' TYR . 58.4 tt0 -169.05 157.67 8.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.392 -0.818 . . . . 0.0 109.02 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -110.04 145.77 36.47 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.464 0.65 . . . . 0.0 110.002 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.541 HH21 ' CG2' ' A' ' 44' ' ' THR . 35.2 mmt180 -96.32 125.24 40.69 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.658 0.742 . . . . 0.0 109.728 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 38.5 p-10 -70.22 -21.5 63.01 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.715 -0.615 . . . . 0.0 109.959 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -62.33 -42.58 99.49 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.764 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.6 pt -116.7 -6.8 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' ARG . 28.0 mmt180 55.82 57.55 5.11 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.4 0.619 . . . . 0.0 110.034 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -144.09 160.17 41.36 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 0.0 109.788 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -90.23 129.28 36.5 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.628 -0.67 . . . . 0.0 109.375 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 11.8 m -141.93 148.97 51.15 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.447 -0.783 . . . . 0.0 109.544 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -41.48 110.1 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.294 0 C-N-CA 122.307 2.004 . . . . 0.0 111.536 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.427 ' CZ ' ' OE1' ' A' ' 16' ' ' GLN . 56.2 t80 -103.66 116.74 32.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -139.77 144.29 37.35 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.1 mt -109.96 130.45 55.53 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.407 HD13 HG23 ' A' ' 30' ' ' ILE . 96.8 mt -112.71 131.04 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -129.04 132.3 47.46 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -83.89 138.78 33.01 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.427 -0.796 . . . . 0.0 109.619 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.7 t . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.407 -0.808 . . . . 0.0 110.36 -179.44 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.484 1.226 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.28 140.75 45.28 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.141 1.894 . . . . 0.0 112.582 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.403 HG22 HD12 ' A' ' 41' ' ' ILE . 36.6 mm -114.93 103.27 54.85 Favored Pre-proline 0 N--CA 1.494 1.735 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.18 145.1 38.51 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.095 1.863 . . . . 0.0 112.061 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.64 137.49 46.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.548 -0.72 . . . . 0.0 109.457 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.541 ' CG2' HH21 ' A' ' 18' ' ' ARG . 45.8 p -138.09 167.85 20.95 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -130.99 140.39 38.53 Favored Pre-proline 0 N--CA 1.491 1.589 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -43.33 -28.25 1.49 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 122.207 1.938 . . . . 0.0 112.089 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.51 158.79 26.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.317 -0.864 . . . . 0.0 110.158 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -126.8 147.75 49.99 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.637 -0.665 . . . . 0.0 109.389 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.516 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 78.9 m-85 -152.44 114.52 4.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.326 -0.859 . . . . 0.0 109.801 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -71.13 -33.49 70.15 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.529 -0.732 . . . . 0.0 109.207 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -69.74 135.34 49.65 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.528 -0.733 . . . . 0.0 110.332 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.52 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 85.1 tt0 -71.74 -41.05 68.96 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.503 -0.748 . . . . 0.0 109.731 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.21 -45.94 86.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -0.874 . . . . 0.0 109.738 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.516 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.0 t0 -63.99 -38.58 91.6 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.346 -0.846 . . . . 0.0 109.546 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.64 91.83 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.47 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.81 -46.39 82.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.345 -0.847 . . . . 0.0 109.724 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -64.21 -44.38 92.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.325 -0.859 . . . . 0.0 109.621 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.3 t -67.32 -42.03 87.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.393 -0.817 . . . . 0.0 109.761 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.5 p -56.49 -40.75 75.47 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.688 -178.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.413 HD12 HG22 ' A' ' 60' ' ' ILE . 96.6 mt -64.13 -45.66 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.983 -1.073 . . . . 0.0 109.155 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.09 -38.8 86.34 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.6 t -64.95 -50.55 65.98 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.537 -0.727 . . . . 0.0 109.437 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.66 -41.71 43.44 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.62 -0.675 . . . . 0.0 109.634 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.4 ' NZ ' ' CG2' ' A' ' 60' ' ' ILE . 63.2 mttp -62.9 -41.35 99.41 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.293 -0.879 . . . . 0.0 109.337 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.5 mt -64.1 -43.84 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.839 . . . . 0.0 109.805 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -65.54 -45.33 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.0 109.129 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.431 HD13 HG23 ' A' ' 67' ' ' ILE . 97.5 mt -64.62 -44.84 96.71 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.163 -0.961 . . . . 0.0 109.371 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -67.59 -43.78 79.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.333 -0.854 . . . . 0.0 109.719 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.0 p -67.04 -35.59 80.21 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.385 -0.822 . . . . 0.0 109.067 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.38 -43.99 92.81 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.285 -0.884 . . . . 0.0 109.394 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.9 mt -63.75 -40.99 98.06 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.377 -0.827 . . . . 0.0 109.218 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.438 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 57.3 t0 . . . . . 0 C--N 1.303 -1.454 0 O-C-N 121.351 -0.843 . . . . 0.0 109.198 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.409 ' C ' ' O ' ' A' ' 77' ' ' GLY . 9.1 mt 41.68 22.99 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.52 -0.988 . . . . 0.0 109.586 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' A' ' 77' ' ' GLY . . . -60.21 -47.71 84.81 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.55 -0.719 . . . . 0.0 109.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -65.68 -36.54 83.93 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.339 -0.85 . . . . 0.0 109.451 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.9 mt -84.09 -3.19 57.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.388 -0.82 . . . . 0.0 109.255 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 179.984 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.439 0.637 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -89.36 159.99 17.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.453 -0.779 . . . . 0.0 109.815 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.91 139.88 47.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.553 -0.717 . . . . 0.0 109.392 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -151.05 119.98 6.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.189 -0.945 . . . . 0.0 109.496 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 54.28 28.04 8.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.648 -0.658 . . . . 0.0 110.199 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 0.21 86.34 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -104.35 139.99 38.53 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.578 -0.954 . . . . 0.0 109.504 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.2 140.74 29.16 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.406 -0.809 . . . . 0.0 109.144 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.42 HD12 HG22 ' A' ' 11' ' ' ILE . 96.7 mt -119.83 130.13 74.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -117.11 121.04 32.96 Favored Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.02 157.68 46.6 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.059 1.839 . . . . 0.0 112.565 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.05 -172.27 44.3 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -150.7 146.06 26.21 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.339 -1.095 . . . . 0.0 109.073 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.51 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 53.8 tt0 -168.47 155.62 7.66 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.276 -0.89 . . . . 0.0 109.002 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -104.91 139.9 38.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.494 -0.754 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.2 mtp180 -90.97 134.43 34.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.559 -0.713 . . . . 0.0 109.566 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 39.0 p-10 -68.29 -21.49 64.78 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.368 -0.833 . . . . 0.0 109.247 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -60.9 -47.68 85.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.554 -0.716 . . . . 0.0 109.867 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 18.6 pt -107.39 -2.5 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.473 -0.767 . . . . 0.0 108.99 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 49.21 46.64 22.77 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.504 -0.747 . . . . 0.0 110.051 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.25 165.9 26.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -0.821 . . . . 0.0 109.598 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -85.04 132.78 34.28 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.541 -0.725 . . . . 0.0 109.766 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.77 156.03 41.26 Favored Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.285 -0.884 . . . . 0.0 108.794 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -43.85 128.94 7.26 Favored 'Trans proline' 0 C--N 1.314 -1.273 0 C-N-CA 122.11 1.873 . . . . 0.0 112.067 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.51 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 66.0 t80 -131.85 120.38 22.5 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.53 151.71 39.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.168 -0.958 . . . . 0.0 108.789 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.2 mt -106.11 129.93 54.1 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.6 mt -110.68 130.44 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.638 -0.664 . . . . 0.0 109.32 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -131.24 126.66 36.06 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -81.49 139.24 35.28 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.339 -0.851 . . . . 0.0 109.741 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 69.9 t . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 110.246 -179.546 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.487 1.382 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -73.01 152.58 51.63 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 122.339 2.026 . . . . 0.0 112.512 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.6 mm -129.0 89.3 49.1 Favored Pre-proline 0 N--CA 1.499 1.987 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -56.1 145.75 73.87 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.317 2.011 . . . . 0.0 111.547 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -117.1 135.4 53.77 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.556 0.693 . . . . 0.0 109.821 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.0 p -138.03 166.2 24.68 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -133.01 133.89 23.74 Favored Pre-proline 0 N--CA 1.495 1.798 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.82 85.14 1.36 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.957 1.772 . . . . 0.0 112.329 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.444 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 80.7 tt0 -138.62 -16.18 1.17 Allowed 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 47' ' ' GLU . 9.6 m-85 58.39 119.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.131 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.533 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 12.4 m-85 -131.37 133.97 45.82 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.736 0.779 . . . . 0.0 109.419 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -85.06 -24.76 27.99 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.706 -0.621 . . . . 0.0 109.456 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.4 mm? -96.91 126.17 41.87 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 122.079 0.943 . . . . 0.0 109.854 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -67.76 -33.36 74.68 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.53 -47.32 86.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.609 -0.682 . . . . 0.0 110.016 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 14.9 t70 -64.35 -34.39 78.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.513 -0.742 . . . . 0.0 109.342 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.423 ' O ' ' OG ' ' A' ' 59' ' ' SER . . . -59.2 -42.3 90.58 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.564 -0.71 . . . . 0.0 109.538 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -64.13 -49.3 72.72 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.449 -0.782 . . . . 0.0 109.845 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -43.93 95.5 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.488 -0.758 . . . . 0.0 109.418 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.3 t -64.17 -42.27 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.374 -0.829 . . . . 0.0 109.286 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 55' ' ' ALA . 31.2 m -52.39 -42.95 64.44 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.272 -0.892 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.02 -44.77 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.279 -0.888 . . . . 0.0 109.265 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.89 71.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.438 -0.789 . . . . 0.0 109.698 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.93 -43.29 99.16 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.484 -0.76 . . . . 0.0 109.147 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.34 -42.44 41.74 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.403 -0.811 . . . . 0.0 109.285 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -62.58 -43.67 98.23 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.38 -0.825 . . . . 0.0 109.251 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -65.82 -45.19 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.502 -0.749 . . . . 0.0 109.791 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.3 -44.47 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 0.0 109.165 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.03 -45.02 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.134 -0.979 . . . . 0.0 109.112 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -65.13 -44.26 89.23 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.468 -0.77 . . . . 0.0 109.606 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.4 m -63.76 -36.64 84.55 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.583 -0.698 . . . . 0.0 109.641 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 13.6 t60 -57.8 -50.62 72.66 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.1 mt -66.5 -42.01 88.03 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.48 -0.762 . . . . 0.0 110.171 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.36 -0.838 . . . . 0.0 110.279 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.451 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.4 mt 55.1 20.44 3.31 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.491 -1.005 . . . . 0.0 109.388 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.92 89.17 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.416 -0.802 . . . . 0.0 109.677 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.01 -37.45 87.25 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.362 -0.836 . . . . 0.0 109.475 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 44.1 mt -82.48 -3.8 56.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.383 -0.823 . . . . 0.0 109.428 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.481 ' CG1' ' OE1' ' A' ' 12' ' ' GLU . 15.3 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.636 0.731 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.73 153.02 19.18 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.501 -0.749 . . . . 0.0 109.622 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -103.65 128.65 50.93 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.574 -0.704 . . . . 0.0 109.771 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.428 ' OH ' ' OD2' ' A' ' 68' ' ' ASP . 69.8 t80 -143.03 121.89 12.7 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.403 -0.811 . . . . 0.0 109.574 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 54.14 24.73 5.06 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.534 0.683 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.62 4.09 80.16 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.684 ' HH ' ' HZ2' ' A' ' 32' ' ' LYS . 81.5 m-85 -109.53 139.5 44.46 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.532 -0.981 . . . . 0.0 109.975 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -87.28 144.93 26.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.391 -0.818 . . . . 0.0 109.577 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.421 HD12 HG21 ' A' ' 11' ' ' ILE . 96.6 mt -123.47 131.79 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.667 -0.645 . . . . 0.0 109.417 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.481 ' OE1' ' CG1' ' A' ' 3' ' ' VAL . 8.8 tp10 -116.0 117.63 39.19 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.19 155.0 32.96 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.187 1.925 . . . . 0.0 112.845 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.99 -163.76 36.2 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -151.27 146.46 26.06 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.026 -1.279 . . . . 0.0 109.346 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.48 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 49.2 tt0 -166.23 155.31 11.34 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.165 -0.959 . . . . 0.0 109.755 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -107.24 135.51 48.64 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.316 0.579 . . . . 0.0 109.849 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.491 ' O ' ' N ' ' A' ' 22' ' ' ARG . 79.9 mtp85 -96.08 137.97 34.38 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.83 0.824 . . . . 0.0 109.981 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -67.31 -21.98 65.65 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.524 0.678 . . . . 0.0 109.306 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.61 -44.52 96.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.449 -0.782 . . . . 0.0 109.906 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.1 pt -114.68 0.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.491 ' N ' ' O ' ' A' ' 18' ' ' ARG . 84.5 mtt85 43.56 41.08 3.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.546 -0.721 . . . . 0.0 110.235 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -136.69 159.83 40.65 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.414 -0.804 . . . . 0.0 109.793 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -87.18 119.23 27.2 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.453 0.644 . . . . 0.0 109.735 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.6 m -130.93 152.83 81.32 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -41.74 114.11 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.722 1.615 . . . . 0.0 111.282 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.48 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 64.7 t80 -111.47 121.32 44.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.595 -0.691 . . . . 0.0 109.644 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.56 154.98 44.15 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.326 -0.859 . . . . 0.0 108.985 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.0 mt -112.31 132.46 54.95 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -113.09 131.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.4 ttm-85 -132.67 136.69 46.61 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.605 -0.685 . . . . 0.0 109.689 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.684 ' HZ2' ' HH ' ' A' ' 9' ' ' TYR . 64.0 tttp -80.19 134.29 36.12 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.689 0.757 . . . . 0.0 109.735 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t . . . . . 0 N--CA 1.488 1.468 0 O-C-N 121.479 -0.763 . . . . 0.0 110.501 -179.25 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.2 m . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.95 154.13 37.89 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.169 1.913 . . . . 0.0 112.682 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.3 mp -121.99 130.12 24.86 Favored Pre-proline 0 N--CA 1.494 1.738 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.4 148.93 55.68 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.125 1.883 . . . . 0.0 112.488 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.98 129.99 54.55 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.3 p -140.05 167.41 22.2 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 47' ' ' GLU . 9.2 t80 -135.58 136.53 24.02 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.637 -0.664 . . . . 0.0 109.626 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -45.38 81.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.373 2.049 . . . . 0.0 112.183 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 45' ' ' TYR . 6.3 pt-20 178.08 133.8 0.07 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -116.61 163.17 16.5 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.725 0.774 . . . . 0.0 109.491 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.512 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 90.0 m-85 -145.15 -35.24 0.32 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.583 -0.698 . . . . 0.0 109.257 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 49' ' ' TYR . 5.4 t0 79.84 -18.12 0.53 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 51' ' ' LEU . 3.6 mm? -98.98 126.36 44.66 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 122.185 0.993 . . . . 0.0 110.153 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -32.25 73.7 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.88 -51.79 66.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.307 -0.871 . . . . 0.0 109.914 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.512 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 39.2 t0 -72.14 -36.76 69.45 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.711 0.767 . . . . 0.0 109.486 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.08 -47.37 85.49 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.424 -0.798 . . . . 0.0 109.922 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.42 -45.1 89.01 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -63.87 -45.09 91.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.127 -0.983 . . . . 0.0 109.924 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -67.56 -42.34 86.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.333 -0.854 . . . . 0.0 109.093 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 99.9 p -55.76 -40.61 72.84 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.446 -0.784 . . . . 0.0 109.668 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.1 mt -64.94 -45.01 96.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.95 -1.094 . . . . 0.0 109.646 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.44 -42.26 79.11 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.048 -1.033 . . . . 0.0 109.549 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 90.6 m -68.55 -39.16 81.19 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.459 -0.776 . . . . 0.0 109.476 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -46.79 71.34 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.238 -0.914 . . . . 0.0 109.064 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -63.17 -41.73 99.28 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.418 HD11 HG22 ' A' ' 65' ' ' ILE . 97.2 mt -65.39 -42.79 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.823 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.2 mm -63.69 -43.24 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.04 -1.037 . . . . 0.0 109.191 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 91.8 mt -62.88 -47.71 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 120.993 -1.067 . . . . 0.0 109.377 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.428 ' OD2' ' OH ' ' A' ' 6' ' ' TYR . 97.9 m-20 -66.14 -44.12 85.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.381 -0.824 . . . . 0.0 109.698 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.8 t -63.23 -41.43 99.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.487 -0.758 . . . . 0.0 109.315 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.504 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 73.5 t60 -58.77 -39.08 79.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.423 -0.798 . . . . 0.0 109.634 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.4 -42.54 98.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.223 -0.923 . . . . 0.0 110.112 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.234 -0.917 . . . . 0.0 110.192 -179.466 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.543 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.493 2.444 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.8 mt 63.04 -9.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 122.004 -0.704 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.543 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.9 -34.17 77.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.003 -1.06 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -65.01 -13.95 59.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.428 -0.795 . . . . 0.0 109.474 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.99 -5.17 59.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.22 -0.925 . . . . 0.0 109.003 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.79 -1.561 . . . . 0.0 109.321 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.128 0.489 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.22 135.44 54.68 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.637 -0.664 . . . . 0.0 109.28 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m170 -84.6 146.7 27.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.429 -0.794 . . . . 0.0 110.373 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -154.6 119.16 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.527 -0.733 . . . . 0.0 109.117 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? 54.69 26.81 7.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.627 -0.67 . . . . 0.0 109.921 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.63 2.8 81.59 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -107.45 140.08 40.96 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.553 -0.969 . . . . 0.0 109.709 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -89.92 142.08 28.04 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.5 -0.75 . . . . 0.0 109.476 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -123.97 132.75 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -119.91 87.95 39.35 Favored Pre-proline 0 N--CA 1.496 1.835 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.66 149.4 68.12 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 122.734 2.289 . . . . 0.0 112.463 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.24 139.68 4.69 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 15' ' ' HIS . 45.2 p-80 -95.1 123.23 38.48 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.521 -0.988 . . . . 0.0 109.96 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -149.91 153.16 36.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.156 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -104.36 138.9 40.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.636 -0.665 . . . . 0.0 109.468 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -103.02 141.9 35.02 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.489 0.661 . . . . 0.0 110.349 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -68.77 -8.81 46.57 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.292 -0.88 . . . . 0.0 109.378 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -68.06 -52.86 30.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.438 ' CD1' ' H ' ' A' ' 23' ' ' LYS . 1.2 pp -108.26 7.27 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 40.89 37.92 0.59 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.823 -0.548 . . . . 0.0 110.123 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.438 ' H ' ' CD1' ' A' ' 21' ' ' ILE . 34.7 mmtt -141.16 176.79 8.55 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.352 -0.843 . . . . 0.0 109.706 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -86.82 127.43 35.01 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.303 0.573 . . . . 0.0 109.633 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -138.61 154.75 73.52 Favored Pre-proline 0 N--CA 1.493 1.681 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -58.52 110.29 0.63 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.239 1.959 . . . . 0.0 111.496 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -112.62 118.4 34.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.514 -0.741 . . . . 0.0 109.37 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.01 153.6 42.39 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -102.82 133.88 47.16 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.634 -0.666 . . . . 0.0 109.554 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.415 HG21 HD13 ' A' ' 30' ' ' ILE . 97.3 mt -110.0 128.07 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -136.41 138.86 41.98 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.628 -0.67 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -93.61 134.69 35.65 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.474 -0.766 . . . . 0.0 109.556 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.589 -0.694 . . . . 0.0 110.224 -179.554 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.1 m . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.54 143.49 55.87 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 122.35 2.034 . . . . 0.0 112.127 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.3 mp -124.03 125.04 25.89 Favored Pre-proline 0 N--CA 1.491 1.601 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -71.63 143.96 43.37 Favored 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 121.842 1.694 . . . . 0.0 112.278 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 t -107.2 137.0 46.09 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -130.52 165.07 23.48 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.536 ' O ' ' N ' ' A' ' 47' ' ' GLU . 24.2 t80 -139.1 110.74 7.81 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -45.53 83.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.966 1.777 . . . . 0.0 112.33 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 45' ' ' TYR . 8.4 tm-20 -171.91 132.24 0.69 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.252 -0.905 . . . . 0.0 109.085 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -98.9 125.66 44.37 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 108.991 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.549 ' C ' ' H ' ' A' ' 51' ' ' LEU . 84.8 m-85 -109.03 -32.37 7.27 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.6 t0 62.97 -3.8 0.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.549 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.4 mt -115.47 131.54 56.9 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.595 -0.691 . . . . 0.0 109.737 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -68.47 -39.43 81.39 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.651 -0.656 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -50.34 74.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.74 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -64.34 -40.2 95.41 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.46 -0.775 . . . . 0.0 109.427 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.77 92.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.476 -0.765 . . . . 0.0 109.95 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -66.98 -49.37 65.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.403 -0.81 . . . . 0.0 110.1 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -64.98 -44.2 90.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.334 -0.854 . . . . 0.0 109.659 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.7 t -66.7 -42.37 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.56 -0.712 . . . . 0.0 109.564 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 p -54.72 -40.41 69.22 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.245 -0.909 . . . . 0.0 109.549 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -65.22 -45.02 95.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.204 -0.935 . . . . 0.0 109.368 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.34 51.83 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.404 -0.81 . . . . 0.0 109.733 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.1 m -60.92 -38.9 87.36 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.557 -0.715 . . . . 0.0 109.28 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.86 -41.12 70.42 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.46 -0.775 . . . . 0.0 109.188 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.18 -38.71 92.24 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.338 -0.852 . . . . 0.0 109.123 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.56 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.453 -0.779 . . . . 0.0 109.665 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.35 -44.35 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.339 -0.851 . . . . 0.0 108.746 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.68 -44.36 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.313 -0.867 . . . . 0.0 109.272 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.49 -41.51 96.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.563 -0.711 . . . . 0.0 109.573 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -61.58 -41.99 98.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.529 -0.732 . . . . 0.0 110.012 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -61.21 -47.16 87.4 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.125 -0.984 . . . . 0.0 109.467 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.87 -42.2 95.03 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.481 -0.762 . . . . 0.0 109.321 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 N--CA 1.487 1.401 0 O-C-N 121.553 -0.717 . . . . 0.0 109.653 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.689 -1.365 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.3 mt -112.16 32.68 5.35 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.959 . . . . 0.0 109.138 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.71 88.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.553 -0.717 . . . . 0.0 109.554 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.69 -34.77 79.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.595 -0.691 . . . . 0.0 109.899 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.2 mt -80.18 -2.93 46.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.617 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 CA-C-O 117.866 -1.519 . . . . 0.0 109.428 179.747 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.688 0.756 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.04 131.3 43.98 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.76 0.79 . . . . 0.0 109.706 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -83.86 149.26 26.49 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.671 0.748 . . . . 0.0 110.184 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -153.43 113.65 3.96 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.763 0.792 . . . . 0.0 109.401 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.8 mtp180 49.41 29.52 2.88 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.631 0.729 . . . . 0.0 110.104 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 96.23 -19.61 53.77 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -83.71 142.14 30.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -1.029 . . . . 0.0 110.625 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.49 145.81 24.53 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.624 -0.673 . . . . 0.0 109.604 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 94.6 mt -125.21 129.72 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-O 121.483 0.659 . . . . 0.0 109.483 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -123.68 93.23 47.73 Favored Pre-proline 0 N--CA 1.495 1.781 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.49 157.46 32.58 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.759 2.306 . . . . 0.0 113.209 -178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.3 -133.71 1.75 Allowed Glycine 0 N--CA 1.488 2.153 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.545 ' ND1' ' OE2' ' A' ' 52' ' ' GLU . 20.2 p-80 -160.05 135.67 8.33 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.435 -1.038 . . . . 0.0 109.899 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.525 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 54.2 tt0 -166.62 154.4 9.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.639 -0.663 . . . . 0.0 109.301 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.9 p90 -112.79 144.62 42.01 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 121.711 0.767 . . . . 0.0 109.942 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -99.15 137.67 37.35 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.622 0.725 . . . . 0.0 109.969 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -68.21 -20.31 64.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.774 -0.579 . . . . 0.0 109.886 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -65.37 -42.43 92.75 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.314 -0.866 . . . . 0.0 109.917 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 11.4 pt -109.91 -6.16 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.47 -0.769 . . . . 0.0 109.016 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 48.25 44.13 19.45 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.807 0.813 . . . . 0.0 109.964 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -145.56 163.21 35.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.509 -0.745 . . . . 0.0 110.202 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -86.22 132.12 34.08 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.843 0.83 . . . . 0.0 110.229 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.8 m -142.49 148.72 48.22 Favored Pre-proline 0 N--CA 1.491 1.592 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -39.94 109.99 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.395 2.063 . . . . 0.0 111.416 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.525 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 56.1 t80 -104.08 120.29 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.603 0.716 . . . . 0.0 109.961 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -142.13 145.8 34.65 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.496 -0.753 . . . . 0.0 109.097 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 65.7 mt -110.14 126.57 54.2 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.401 HD12 HG23 ' A' ' 30' ' ' ILE . 91.0 mt -104.05 127.45 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.516 0.674 . . . . 0.0 109.532 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -130.1 137.98 50.45 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.59 0.71 . . . . 0.0 109.464 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -95.2 130.53 41.9 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 109.28 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.3 -179.252 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.71 144.14 98.2 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.348 2.032 . . . . 0.0 112.393 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.14 89.97 51.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -52.87 141.6 55.04 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 C-N-CA 122.517 2.145 . . . . 0.0 112.227 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.1 t -108.65 134.61 51.15 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.812 0.815 . . . . 0.0 110.003 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 56.9 p -139.66 166.85 23.5 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.608 ' O ' ' N ' ' A' ' 47' ' ' GLU . 8.8 t80 -136.05 133.42 19.7 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -42.78 76.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.898 2.399 . . . . 0.0 112.382 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.608 ' N ' ' O ' ' A' ' 45' ' ' TYR . 39.8 mt-10 -155.06 145.05 21.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.564 -0.71 . . . . 0.0 109.131 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -115.39 110.15 18.93 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.696 -0.628 . . . . 0.0 109.345 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -124.28 129.79 51.37 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.557 0.694 . . . . 0.0 109.669 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -92.99 -24.84 18.23 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -78.68 143.02 36.67 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.826 0.822 . . . . 0.0 110.323 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.545 ' OE2' ' ND1' ' A' ' 15' ' ' HIS . 46.2 tp10 -71.89 -38.49 69.97 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.578 0.704 . . . . 0.0 109.758 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.97 87.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.79 . . . . 0.0 109.862 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -63.68 -43.43 96.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 109.739 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.12 88.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.512 -0.743 . . . . 0.0 109.899 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -69.37 -45.08 70.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.487 -0.758 . . . . 0.0 110.08 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -64.07 -45.4 88.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.335 -0.853 . . . . 0.0 110.037 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.7 t -67.53 -41.79 86.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.558 0.694 . . . . 0.0 109.742 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.1 p -57.18 -42.43 81.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.37 -0.831 . . . . 0.0 110.045 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.417 HD13 HG23 ' A' ' 60' ' ' ILE . 96.6 mt -64.87 -45.07 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.117 -0.989 . . . . 0.0 109.645 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.89 -49.45 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.222 -0.924 . . . . 0.0 109.805 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.1 m -61.82 -35.19 77.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.473 -0.767 . . . . 0.0 109.485 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.55 -41.03 89.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.395 -0.815 . . . . 0.0 109.523 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.26 -45.74 86.78 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.296 -0.877 . . . . 0.0 109.805 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 3.0 mp -67.47 -42.08 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.369 -0.832 . . . . 0.0 109.818 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -62.22 -43.74 98.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 121.384 -0.822 . . . . 0.0 109.789 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.95 -44.71 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.228 -0.92 . . . . 0.0 109.319 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.457 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 73.9 m-20 -64.24 -44.06 92.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.378 -0.826 . . . . 0.0 109.264 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.2 p -64.47 -47.6 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 0.0 109.768 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.684 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 53.8 t60 -47.06 -44.02 20.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.293 -0.879 . . . . 0.0 109.441 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.34 -40.72 98.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.38 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 N--CA 1.497 1.894 0 O-C-N 121.453 -0.779 . . . . 0.0 109.266 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.684 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 59.5 mt -102.59 14.65 31.42 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.326 -1.102 . . . . 0.0 109.201 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.12 -26.08 68.38 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.505 -0.747 . . . . 0.0 109.9 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -68.08 -17.16 64.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.325 -0.859 . . . . 0.0 109.676 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.9 mt -92.93 -2.13 56.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.186 -0.947 . . . . 0.0 109.262 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.807 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.8 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.666 0.746 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.8 139.89 48.05 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -101.63 122.48 43.95 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.737 0.779 . . . . 0.0 109.876 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -101.69 -101.12 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.403 0.621 . . . . 0.0 109.509 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -90.96 51.46 1.96 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.361 -0.837 . . . . 0.0 109.546 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.7 90.51 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.06 138.19 44.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.506 -0.997 . . . . 0.0 109.896 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -80.45 141.07 35.6 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.629 -0.669 . . . . 0.0 109.379 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.433 HG23 HD13 ' A' ' 11' ' ' ILE . 97.6 mt -119.47 129.0 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.38 0.61 . . . . 0.0 109.448 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -132.22 97.97 17.58 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -76.94 154.11 33.3 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.622 2.215 . . . . 0.0 112.868 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.2 102.89 0.17 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -42.05 129.68 3.6 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.69 -0.888 . . . . 0.0 110.713 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.448 ' CD ' ' H ' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -156.93 158.1 36.02 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.614 0.721 . . . . 0.0 109.427 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.448 ' H ' ' CD ' ' A' ' 16' ' ' GLN . 48.3 p90 -113.5 145.8 40.63 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.817 0.817 . . . . 0.0 110.038 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.625 HH21 ' CG2' ' A' ' 44' ' ' THR . 32.3 mmt180 -92.51 130.75 38.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.767 0.794 . . . . 0.0 109.612 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 45.1 p-10 -71.72 -23.78 61.68 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.73 -0.606 . . . . 0.0 109.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 90.7 m-20 -61.79 -44.64 96.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.6 pt -109.39 -7.63 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.378 -0.826 . . . . 0.0 109.102 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' ARG . 80.5 mtp85 54.8 53.43 10.51 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.591 0.71 . . . . 0.0 110.197 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -146.53 162.36 38.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.383 -0.823 . . . . 0.0 110.377 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -88.14 128.53 35.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.617 -0.677 . . . . 0.0 109.664 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.8 m -147.14 148.24 31.45 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.484 -0.76 . . . . 0.0 109.391 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -42.47 109.23 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 122.282 1.988 . . . . 0.0 111.508 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -112.39 120.96 43.47 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.347 -0.846 . . . . 0.0 110.163 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.72 145.67 42.79 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 83.1 mt -101.78 130.26 48.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.537 -0.727 . . . . 0.0 109.301 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.432 HD11 HG22 ' A' ' 30' ' ' ILE . 93.1 mt -109.64 124.4 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 CA-C-O 121.579 0.704 . . . . 0.0 109.901 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -130.61 140.44 50.42 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.644 0.735 . . . . 0.0 109.572 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -86.9 137.25 32.54 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-O 121.606 0.717 . . . . 0.0 109.643 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.806 0.812 . . . . 0.0 110.583 -179.459 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 N--CA 1.495 1.797 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.08 146.91 46.14 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.427 2.085 . . . . 0.0 112.721 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -109.75 111.02 59.19 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.55 157.42 44.67 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.546 2.164 . . . . 0.0 112.461 -179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -121.97 135.55 54.86 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.577 0.703 . . . . 0.0 109.71 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.625 ' CG2' HH21 ' A' ' 18' ' ' ARG . 43.7 p -131.03 166.84 20.14 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' A' ' 47' ' ' GLU . 1.1 t80 -135.58 133.19 20.08 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.509 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 77.1 Cg_exo -45.23 -12.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.313 2.009 . . . . 0.0 111.468 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' TYR . 97.0 mt-10 -84.0 160.27 21.05 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.57 -0.706 . . . . 0.0 109.937 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.557 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -131.28 148.65 52.71 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.598 0.713 . . . . 0.0 109.362 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.527 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 62.4 m-85 -149.62 118.91 6.82 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.477 -0.765 . . . . 0.0 109.241 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -74.12 -13.39 60.82 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -94.67 128.54 41.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 109.877 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.524 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -67.79 -36.15 79.93 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.483 0.659 . . . . 0.0 110.19 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.36 -43.87 92.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.365 -0.834 . . . . 0.0 109.753 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 51.3 t0 -65.94 -38.85 89.7 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.417 -0.802 . . . . 0.0 109.544 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.95 -37.07 86.07 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.531 -0.731 . . . . 0.0 109.595 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -64.48 -50.24 68.23 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.392 -0.818 . . . . 0.0 109.807 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -67.27 -44.06 80.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.833 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.4 t -67.4 -42.98 87.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.457 -0.777 . . . . 0.0 110.238 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 77.8 p -59.6 -41.08 89.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 110.206 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -65.83 -44.44 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 120.987 -1.07 . . . . 0.0 109.473 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -45.2 76.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.437 -0.789 . . . . 0.0 109.898 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.57 -46.38 72.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.361 -0.837 . . . . 0.0 109.985 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -48.2 -46.15 34.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.448 -0.783 . . . . 0.0 109.799 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.34 -41.82 98.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.361 -0.837 . . . . 0.0 109.418 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 91.0 mt -64.47 -44.03 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.505 -0.747 . . . . 0.0 109.691 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.15 -43.99 99.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.01 -44.03 99.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 O-C-N 121.583 -0.698 . . . . 0.0 109.2 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.23 -42.62 93.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.668 0.747 . . . . 0.0 109.301 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.7 t -69.92 -34.12 73.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.554 -0.716 . . . . 0.0 109.789 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.472 ' CD2' ' C ' ' A' ' 70' ' ' HIS . 0.0 OUTLIER -57.75 -47.74 81.62 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.282 -0.886 . . . . 0.0 108.78 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.5 mt -64.25 -40.32 95.77 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.9 t0 . . . . . 0 C--N 1.298 -1.672 0 CA-C-O 121.508 0.67 . . . . 0.0 109.711 179.599 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.916 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.436 ' H ' ' CD2' ' A' ' 70' ' ' HIS . 46.5 mt -109.84 32.96 4.67 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.514 -0.992 . . . . 0.0 108.854 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.42 76.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.519 -0.738 . . . . 0.0 109.315 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.92 -37.44 87.4 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.424 -0.797 . . . . 0.0 109.261 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.5 mt -86.8 -5.69 59.04 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.096 -1.002 . . . . 0.0 108.805 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.92 -1.489 . . . . 0.0 109.413 179.507 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 121.813 0.816 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.29 146.77 31.1 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -102.83 136.9 41.8 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.741 0.781 . . . . 0.0 110.217 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -149.38 120.69 7.85 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.77 0.795 . . . . 0.0 109.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 48.98 30.84 2.96 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.741 0.781 . . . . 0.0 110.452 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.32 -20.26 41.85 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -81.02 144.16 31.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.341 -1.093 . . . . 0.0 110.299 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -104.32 139.07 39.83 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -115.01 137.57 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.648 0.737 . . . . 0.0 110.122 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -118.65 90.0 38.74 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.62 145.85 46.33 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.947 2.431 . . . . 0.0 112.907 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.28 -171.95 40.53 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -149.15 141.02 23.68 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.999 . . . . 0.0 109.773 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -170.02 155.74 5.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.587 -0.696 . . . . 0.0 109.514 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -105.3 137.9 42.36 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.861 0.838 . . . . 0.0 110.146 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.4 141.16 36.44 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.389 0.614 . . . . 0.0 109.585 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 37.4 p-10 -68.44 -8.28 39.3 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.756 0.789 . . . . 0.0 109.349 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -64.27 -42.44 96.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.392 -0.818 . . . . 0.0 109.205 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.412 ' O ' ' C ' ' A' ' 22' ' ' ARG . 1.1 pp -122.58 12.71 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ILE . 89.0 mtm180 38.48 34.62 0.08 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.632 0.729 . . . . 0.0 110.102 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -138.35 169.12 18.35 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.054 0.931 . . . . 0.0 110.359 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -85.3 135.37 33.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.635 0.731 . . . . 0.0 109.891 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -147.37 147.64 28.94 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.377 -0.827 . . . . 0.0 109.493 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -38.19 109.21 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 C-N-CA 122.685 2.257 . . . . 0.0 111.65 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -109.05 112.0 23.94 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.16 145.7 37.84 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.529 -0.732 . . . . 0.0 109.424 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.92 124.87 49.25 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.407 HD13 HG21 ' A' ' 30' ' ' ILE . 97.7 mt -112.36 133.26 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-O 121.461 0.648 . . . . 0.0 109.797 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.99 138.33 43.89 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.613 0.721 . . . . 0.0 109.355 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -83.28 134.76 34.92 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.707 0.765 . . . . 0.0 110.267 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.1 t . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.732 0.777 . . . . 0.0 110.5 -179.727 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.76 151.96 52.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.71 2.274 . . . . 0.0 112.984 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.2 mp -118.38 130.89 24.49 Favored Pre-proline 0 N--CA 1.495 1.78 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.04 145.98 45.88 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.523 2.148 . . . . 0.0 112.246 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.9 t -116.52 137.13 52.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.703 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -138.22 167.65 21.38 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.309 0.576 . . . . 0.0 109.666 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -126.83 145.21 52.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.48 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 81.6 Cg_exo -43.2 -26.31 0.82 Allowed 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.24 1.96 . . . . 0.0 111.574 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -69.73 160.4 31.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.744 . . . . 0.0 110.515 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 46' ' ' PRO . 73.2 m-85 -128.37 146.55 50.74 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.544 0.688 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.518 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 71.8 m-85 -148.55 121.91 9.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.469 -0.769 . . . . 0.0 109.877 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -82.59 -20.18 36.98 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -81.77 136.31 35.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.34 -0.85 . . . . 0.0 109.881 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.86 -40.58 72.23 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.61 0.719 . . . . 0.0 109.778 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.96 99.23 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.411 -0.806 . . . . 0.0 109.807 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.518 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 54.1 t0 -65.26 -39.63 92.9 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.41 -0.806 . . . . 0.0 109.906 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.1 95.0 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.261 -0.899 . . . . 0.0 109.839 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.94 -46.02 76.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.31 -0.869 . . . . 0.0 109.858 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.57 -44.3 91.12 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.236 -0.915 . . . . 0.0 109.95 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.3 t -66.83 -41.71 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.496 -0.752 . . . . 0.0 109.906 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.2 p -56.95 -41.28 78.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.325 -0.86 . . . . 0.0 109.989 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.12 -45.76 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.023 -1.048 . . . . 0.0 109.66 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.52 -53.72 26.17 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.271 -0.893 . . . . 0.0 109.929 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.7 m -62.95 -35.66 80.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.387 -0.821 . . . . 0.0 109.809 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.65 -43.26 76.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.165 -0.96 . . . . 0.0 108.818 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -63.16 -39.66 95.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 0.0 108.747 179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -64.92 -43.62 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.308 -0.87 . . . . 0.0 108.736 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.0 mm -64.29 -43.93 97.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.725 0.774 . . . . 0.0 109.555 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -64.21 -44.24 97.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 O-C-N 121.464 -0.772 . . . . 0.0 109.4 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -64.88 -45.22 86.9 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.81 0.814 . . . . 0.0 109.554 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -62.78 -38.95 92.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.429 -0.794 . . . . 0.0 109.868 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.499 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 79.4 t60 -60.82 -40.95 94.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.21 -0.931 . . . . 0.0 109.852 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.09 -41.73 99.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.373 -0.829 . . . . 0.0 109.823 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.16 -0.962 . . . . 0.0 108.991 179.657 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.528 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.3 mt 59.65 1.16 0.27 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.724 -0.868 . . . . 0.0 109.58 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.528 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.17 -34.46 78.13 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.483 -0.761 . . . . 0.0 109.431 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.98 -41.05 97.6 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.251 -0.906 . . . . 0.0 109.794 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.53 -40.32 96.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.301 -0.875 . . . . 0.0 109.477 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 -179.899 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.498 0.666 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.18 137.42 51.48 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.696 0.76 . . . . 0.0 109.792 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -82.25 151.2 26.92 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.614 0.721 . . . . 0.0 110.086 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -154.51 111.84 3.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.445 ' NH2' ' CD1' ' A' ' 71' ' ' LEU . 84.1 mtp180 49.75 35.59 9.33 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.69 0.757 . . . . 0.0 110.534 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.32 -5.76 83.87 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -105.41 137.34 43.37 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.239 -1.154 . . . . 0.0 110.252 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -89.22 144.85 25.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.746 -0.596 . . . . 0.0 109.461 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.74 130.04 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-O 121.424 0.63 . . . . 0.0 109.391 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.433 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 49.6 tt0 -121.26 117.95 30.27 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.98 154.22 42.44 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.609 2.206 . . . . 0.0 113.023 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.43 -167.3 39.2 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -151.07 156.01 40.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.511 -0.993 . . . . 0.0 109.509 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 57.4 tt0 -152.98 154.1 34.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.544 -0.723 . . . . 0.0 109.08 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -107.95 123.92 49.36 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.777 0.799 . . . . 0.0 110.159 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -96.92 138.3 34.68 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.797 0.808 . . . . 0.0 109.41 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -86.94 -24.29 24.82 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 109.41 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.32 -44.91 93.6 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.432 -0.793 . . . . 0.0 109.543 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.433 ' O ' ' C ' ' A' ' 22' ' ' ARG . 19.7 pt -105.6 9.99 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.449 -0.782 . . . . 0.0 108.994 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.445 ' NH1' ' HZ3' ' A' ' 23' ' ' LYS . 51.8 ptt85 35.8 41.78 0.12 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.655 0.741 . . . . 0.0 110.803 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HZ3' ' NH1' ' A' ' 22' ' ' ARG . 54.6 mttp -146.71 160.63 41.99 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.312 -0.868 . . . . 0.0 110.427 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -85.54 137.48 32.85 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 121.536 0.684 . . . . 0.0 109.854 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.3 m -139.39 151.63 67.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.673 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -45.42 134.3 12.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.429 2.086 . . . . 0.0 112.223 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 71.9 t80 -140.31 113.81 8.64 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.378 -0.826 . . . . 0.0 109.56 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 12' ' ' GLU . . . -138.69 151.12 46.89 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.584 0.707 . . . . 0.0 109.267 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.8 mt -101.74 128.34 48.11 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.481 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 30' ' ' ILE . 95.1 mt -108.62 129.55 62.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -117.04 136.11 53.21 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.717 0.77 . . . . 0.0 109.356 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -101.89 117.91 35.83 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.759 0.79 . . . . 0.0 109.323 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 6.4 t . . . . . 0 C--N 1.3 -1.583 0 CA-C-O 121.606 0.717 . . . . 0.0 109.881 -179.903 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.58 131.75 17.86 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.509 2.139 . . . . 0.0 112.623 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.49 106.63 52.23 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.783 -0.573 . . . . 0.0 109.583 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.478 ' CB ' ' CE1' ' A' ' 27' ' ' TYR . 59.4 Cg_endo -75.6 146.73 30.89 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.472 2.114 . . . . 0.0 112.242 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.15 132.37 53.68 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.612 0.72 . . . . 0.0 109.715 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 p -136.41 167.13 21.91 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.389 0.614 . . . . 0.0 109.605 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -131.65 142.14 44.2 Favored Pre-proline 0 N--CA 1.492 1.657 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -45.98 -35.26 14.03 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.197 1.931 . . . . 0.0 111.576 178.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.48 144.67 56.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.52 -0.738 . . . . 0.0 110.01 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -125.51 148.11 49.0 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.66 0.743 . . . . 0.0 109.847 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.67 129.85 33.39 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.745 0.783 . . . . 0.0 109.497 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 64.7 t0 -66.86 -35.66 80.54 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.563 0.697 . . . . 0.0 109.523 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 72.4 mt -75.21 135.41 41.03 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.953 0.882 . . . . 0.0 110.342 -179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 56' ' ' GLU . 1.7 tm-20 -72.47 -40.05 67.25 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.717 0.77 . . . . 0.0 109.715 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.2 96.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.394 -0.816 . . . . 0.0 109.872 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -64.17 -36.49 84.21 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.323 -0.86 . . . . 0.0 109.25 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.64 89.68 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.403 -0.811 . . . . 0.0 109.182 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 52' ' ' GLU . 97.2 mt-10 -64.39 -45.3 88.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.433 -0.792 . . . . 0.0 109.491 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -64.32 -43.86 93.37 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.375 -0.828 . . . . 0.0 109.677 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.3 -41.55 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.495 -0.753 . . . . 0.0 109.577 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 95.3 p -57.53 -40.38 78.68 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.409 -0.807 . . . . 0.0 109.686 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.78 -46.07 93.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.187 -0.946 . . . . 0.0 109.471 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.75 -52.64 41.91 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.118 -0.988 . . . . 0.0 109.4 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 92.6 m -59.53 -40.28 86.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.314 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -52.97 -40.13 63.5 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.559 -0.713 . . . . 0.0 109.69 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -61.51 -41.18 96.92 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.222 -0.924 . . . . 0.0 109.311 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.501 ' CD1' ' N ' ' A' ' 65' ' ' ILE . 1.4 mp -63.92 -43.85 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.26 -0.9 . . . . 0.0 109.542 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.89 -43.22 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.26 -0.9 . . . . 0.0 109.131 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.3 mt -62.77 -43.78 99.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.213 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -64.32 -43.73 93.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.399 -0.813 . . . . 0.0 109.395 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -63.57 -35.92 82.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.443 -0.785 . . . . 0.0 109.389 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.527 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 64.0 t60 -58.83 -42.86 90.25 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.365 -0.834 . . . . 0.0 109.621 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.445 ' CD1' ' NH2' ' A' ' 7' ' ' ARG . 96.3 mt -63.72 -41.25 98.11 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.356 -0.84 . . . . 0.0 109.093 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 t70 . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 109.229 179.837 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 77' ' ' GLY . 47.5 mt 37.63 34.59 0.05 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.83 0.824 . . . . 0.0 109.575 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.97 85.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.498 -0.751 . . . . 0.0 109.741 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -64.82 -35.43 81.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.213 -0.93 . . . . 0.0 109.186 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.96 -4.41 58.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.209 -0.932 . . . . 0.0 109.257 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.468 0 CA-C-O 117.881 -1.51 . . . . 0.0 109.566 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.497 1.911 0 CA-C-O 121.427 0.632 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.92 159.33 15.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.435 -0.791 . . . . 0.0 109.248 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.6 m170 -109.73 143.45 39.51 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.471 -0.768 . . . . 0.0 109.556 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -152.83 124.38 7.74 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.296 -0.878 . . . . 0.0 109.308 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 53.74 26.04 5.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.621 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.31 2.24 87.76 Favored Glycine 0 N--CA 1.495 2.619 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.94 140.58 38.73 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.35 -1.088 . . . . 0.0 109.554 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.514 -0.741 . . . . 0.0 109.41 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.432 HD11 HG22 ' A' ' 11' ' ' ILE . 96.6 mt -124.76 130.01 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -114.98 113.29 44.19 Favored Pre-proline 0 N--CA 1.497 1.925 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.82 157.34 47.82 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.815 1.677 . . . . 0.0 112.79 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.7 -163.78 37.48 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -148.92 146.3 27.81 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.065 -1.256 . . . . 0.0 109.511 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.48 ' CD ' ' N ' ' A' ' 17' ' ' TYR . 6.5 tm0? -167.61 147.29 5.06 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.31 -0.868 . . . . 0.0 109.087 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.48 ' N ' ' CD ' ' A' ' 16' ' ' GLN . 49.5 p90 -107.63 137.86 44.9 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.4 mtp180 -89.04 136.04 33.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.929 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -71.07 -18.99 62.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -62.21 -45.46 93.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.322 -0.861 . . . . 0.0 109.744 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.11 -2.36 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 48.32 50.27 16.73 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.582 -0.699 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -139.55 157.28 46.08 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.408 -0.808 . . . . 0.0 109.07 178.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -85.73 131.66 34.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.626 -0.672 . . . . 0.0 109.78 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.0 148.75 36.63 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.252 -0.905 . . . . 0.0 109.344 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.74 110.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.325 2.016 . . . . 0.0 111.608 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -108.07 113.2 26.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.153 -0.967 . . . . 0.0 109.234 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.49 154.3 49.91 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.4 -0.813 . . . . 0.0 108.858 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.7 mt -109.69 129.64 55.59 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.6 mt -107.23 128.64 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.683 -0.636 . . . . 0.0 109.399 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -130.43 138.48 50.34 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -82.41 137.98 34.56 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.405 -0.81 . . . . 0.0 109.498 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.1 t . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.403 -0.811 . . . . 0.0 109.851 -179.381 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.63 143.42 68.91 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.124 1.882 . . . . 0.0 112.326 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 24.2 mm -106.01 130.76 22.48 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.313 -0.867 . . . . 0.0 108.734 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.2 148.49 39.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.763 1.642 . . . . 0.0 112.121 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.2 t -120.43 133.58 55.4 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.3 p -136.19 167.75 20.69 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -128.33 143.72 49.18 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.542 -0.724 . . . . 0.0 109.388 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -44.04 -27.36 1.75 Allowed 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 121.939 1.759 . . . . 0.0 112.008 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.24 165.01 14.67 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.396 -0.815 . . . . 0.0 109.917 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -128.4 148.06 50.68 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -150.61 110.88 4.17 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.084 -1.01 . . . . 0.0 109.667 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 68.3 t0 -66.69 -33.58 75.95 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.692 -0.63 . . . . 0.0 109.938 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.0 mt -79.35 138.19 37.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.165 -0.96 . . . . 0.0 110.953 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -70.74 -36.88 73.36 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.567 0.699 . . . . 0.0 109.416 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.29 -49.26 77.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.91 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.59 -36.18 83.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.381 -0.824 . . . . 0.0 108.938 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.25 97.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.33 -0.856 . . . . 0.0 109.563 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.16 -50.02 65.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.271 -0.893 . . . . 0.0 110.194 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -62.92 -44.57 95.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.281 -0.887 . . . . 0.0 109.647 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.28 -42.39 93.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.351 -0.843 . . . . 0.0 109.733 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 93.8 p -55.82 -40.51 72.87 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.711 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.3 -45.32 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.053 -1.029 . . . . 0.0 109.457 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.31 -49.19 62.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.351 -0.843 . . . . 0.0 109.681 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.9 m -62.91 -34.79 78.18 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.529 -0.732 . . . . 0.0 109.436 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.8 -41.8 92.02 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.377 -0.827 . . . . 0.0 109.353 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -62.92 -44.7 95.37 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.197 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.59 -43.51 86.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.481 -0.762 . . . . 0.0 109.21 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.1 mm -62.31 -44.74 99.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.55 -45.05 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.035 -1.041 . . . . 0.0 109.603 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -67.08 -51.59 52.48 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.863 . . . . 0.0 109.741 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.9 m -62.09 -41.45 98.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 109.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.667 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 55.7 t60 -53.19 -43.79 67.43 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.376 -0.827 . . . . 0.0 109.432 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.4 mt -62.61 -42.03 99.33 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.352 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 p30 . . . . . 0 N--CA 1.497 1.908 0 O-C-N 121.36 -0.837 . . . . 0.0 109.997 -179.917 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.483 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.493 2.452 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.667 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 45.8 mt -73.61 37.03 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.129 -1.218 . . . . 0.0 110.21 -178.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -65.44 -35.62 81.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.362 -0.837 . . . . 0.0 109.768 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -62.57 -35.44 79.52 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.383 -0.823 . . . . 0.0 108.986 -179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.24 -2.64 53.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.409 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.584 179.734 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 m . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.514 0.673 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.56 138.23 50.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.586 0.708 . . . . 0.0 109.478 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -91.67 138.91 31.18 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.524 0.678 . . . . 0.0 110.04 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -149.4 121.87 8.51 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.532 -0.73 . . . . 0.0 109.608 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 52.89 29.17 7.36 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.623 0.725 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.97 1.37 88.83 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -105.06 139.86 39.1 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.458 -1.025 . . . . 0.0 109.895 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -87.4 139.67 30.32 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 11' ' ' ILE . 97.9 mt -123.16 129.83 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 121.387 0.613 . . . . 0.0 109.463 -179.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -121.05 92.46 48.51 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.68 148.35 22.76 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.759 2.306 . . . . 0.0 112.801 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.95 161.83 29.77 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -93.88 124.98 38.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.642 -0.917 . . . . 0.0 109.921 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -149.4 153.53 37.51 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.613 -0.679 . . . . 0.0 109.514 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -108.32 136.74 47.46 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.614 0.721 . . . . 0.0 109.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -96.39 138.74 33.53 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.631 0.729 . . . . 0.0 109.756 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.72 -24.59 65.39 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.542 0.687 . . . . 0.0 109.804 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -61.09 -45.1 96.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 110.335 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.9 pt -110.25 -5.07 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.404 -0.81 . . . . 0.0 109.313 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 49.14 42.23 20.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.658 0.742 . . . . 0.0 109.873 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -144.57 165.4 28.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 110.098 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -85.26 128.31 34.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.619 0.723 . . . . 0.0 110.043 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.7 m -146.82 148.07 31.85 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.531 -0.73 . . . . 0.0 109.192 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -40.93 110.31 0.12 Allowed 'Trans proline' 0 C--N 1.315 -1.223 0 C-N-CA 122.503 2.135 . . . . 0.0 112.091 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -114.59 119.87 38.24 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.67 145.05 39.94 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.61 -0.681 . . . . 0.0 109.259 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.4 mt -106.27 131.93 52.91 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.401 HD12 HG23 ' A' ' 30' ' ' ILE . 96.4 mt -114.7 127.46 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 CA-C-O 121.374 0.607 . . . . 0.0 109.487 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -134.26 133.97 41.4 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.451 0.643 . . . . 0.0 109.267 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -81.97 137.63 35.1 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.643 0.735 . . . . 0.0 110.15 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.0 t . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.607 0.717 . . . . 0.0 110.192 -179.763 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.59 143.66 77.96 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.77 2.313 . . . . 0.0 112.528 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.38 130.96 24.09 Favored Pre-proline 0 N--CA 1.491 1.593 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.51 149.01 38.54 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.469 2.113 . . . . 0.0 112.461 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -111.09 133.01 53.79 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -134.85 162.06 33.47 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.611 0.72 . . . . 0.0 109.574 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.623 ' O ' ' N ' ' A' ' 47' ' ' GLU . 12.9 t80 -143.15 135.25 13.19 Favored Pre-proline 0 N--CA 1.487 1.416 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -43.29 76.73 0.01 OUTLIER 'Trans proline' 0 N--CA 1.499 1.797 0 C-N-CA 122.857 2.371 . . . . 0.0 112.207 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.623 ' N ' ' O ' ' A' ' 45' ' ' TYR . 71.1 mm-40 -148.91 148.39 29.78 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.481 -0.762 . . . . 0.0 109.387 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -127.31 118.91 25.1 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -140.51 131.1 25.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.636 -0.665 . . . . 0.0 109.812 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -91.35 -25.43 19.4 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -76.16 143.6 41.06 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.64 0.733 . . . . 0.0 109.972 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -73.1 -40.64 64.82 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.43 0.633 . . . . 0.0 110.176 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.05 92.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.368 -0.832 . . . . 0.0 109.853 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.11 -42.49 96.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.359 -0.838 . . . . 0.0 109.839 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.76 -43.57 88.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.387 -0.821 . . . . 0.0 109.825 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.99 -44.89 75.58 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.804 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -63.85 -45.56 88.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.477 -0.765 . . . . 0.0 109.725 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.13 -42.16 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.579 -0.7 . . . . 0.0 109.777 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 77.9 p -54.73 -41.62 70.58 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.442 -0.786 . . . . 0.0 109.856 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.66 -44.62 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 109.481 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.09 91.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.391 -0.818 . . . . 0.0 109.654 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.35 -46.41 73.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.326 -0.859 . . . . 0.0 109.701 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.37 -43.41 44.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.438 -0.789 . . . . 0.0 109.502 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.74 -42.59 97.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.577 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.412 HG23 HD12 ' A' ' 65' ' ' ILE . 97.4 mt -65.3 -44.64 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.387 -0.821 . . . . 0.0 109.997 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.2 -44.59 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.489 -0.757 . . . . 0.0 109.314 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.4 mt -64.7 -44.33 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -66.15 -44.22 84.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.505 -0.747 . . . . 0.0 109.906 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.3 t -65.66 -40.36 92.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.358 -0.839 . . . . 0.0 110.1 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -59.23 -42.1 90.25 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.903 . . . . 0.0 109.673 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.8 -42.97 99.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.445 -0.784 . . . . 0.0 109.858 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 . . . . . 0 C--N 1.302 -1.496 0 O-C-N 121.382 -0.824 . . . . 0.0 109.584 -179.879 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -102.91 17.1 24.79 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.377 -1.072 . . . . 0.0 109.682 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.49 -28.3 69.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.323 -0.86 . . . . 0.0 109.335 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.404 ' OD1' ' O ' ' A' ' 80' ' ' ASP . 68.0 t0 -64.16 -32.96 74.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.535 -0.728 . . . . 0.0 109.518 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.6 mt -79.59 -3.94 49.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.37 -0.831 . . . . 0.0 109.797 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.019 -1.434 . . . . 0.0 109.744 179.908 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.778 0.799 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.68 159.58 15.15 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.525 0.679 . . . . 0.0 109.775 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -111.64 152.98 27.03 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.738 0.78 . . . . 0.0 110.239 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -139.94 -134.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.671 0.748 . . . . 0.0 109.934 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -72.65 51.99 0.28 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.754 0.788 . . . . 0.0 110.067 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.87 -6.86 82.64 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -105.99 138.7 41.72 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.339 -1.095 . . . . 0.0 110.34 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -85.6 144.7 27.73 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.359 0.599 . . . . 0.0 109.498 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.9 mt -125.32 132.1 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 121.5 0.667 . . . . 0.0 109.877 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -126.03 124.29 24.63 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.1 157.18 38.25 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.608 2.205 . . . . 0.0 112.729 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.69 -169.32 42.26 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.509 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 47.4 p-80 -148.76 146.85 28.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.768 -0.842 . . . . 0.0 109.767 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -169.78 151.35 4.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -109.3 142.95 39.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 121.887 0.851 . . . . 0.0 110.261 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -94.58 136.23 35.12 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.869 0.843 . . . . 0.0 109.477 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 42.3 p30 -68.0 -20.0 64.98 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.424 0.631 . . . . 0.0 109.673 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 98.9 m-20 -62.38 -42.16 99.2 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.5 -0.75 . . . . 0.0 109.639 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.2 pt -115.56 -3.13 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.573 -0.704 . . . . 0.0 109.281 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 49.16 40.54 17.92 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.632 -0.667 . . . . 0.0 109.988 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -135.83 161.16 36.39 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.651 0.739 . . . . 0.0 110.38 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -86.44 128.33 34.94 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 121.574 0.702 . . . . 0.0 109.85 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -137.3 147.6 58.8 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.97 108.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.248 0 C-N-CA 122.631 2.221 . . . . 0.0 112.057 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -106.33 116.97 32.85 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.487 0.66 . . . . 0.0 109.645 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -135.11 141.78 46.08 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.681 0.753 . . . . 0.0 109.079 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.2 mt -105.08 127.08 52.72 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.65 0.738 . . . . 0.0 109.309 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -115.16 130.46 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.458 0.647 . . . . 0.0 109.465 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.96 134.85 47.72 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.912 0.863 . . . . 0.0 109.672 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -82.6 137.33 34.56 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.872 0.844 . . . . 0.0 110.202 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.9 t . . . . . 0 C--N 1.3 -1.57 0 CA-C-O 121.676 0.751 . . . . 0.0 110.199 -179.772 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.64 145.53 29.86 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.18 1.92 . . . . 0.0 112.427 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.9 mm -114.82 95.39 41.04 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.17 142.94 43.91 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.7 2.267 . . . . 0.0 112.447 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.74 138.38 44.09 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.692 0.758 . . . . 0.0 110.102 -179.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.2 p -139.24 166.65 23.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.497 0.665 . . . . 0.0 109.48 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.59 ' O ' ' N ' ' A' ' 47' ' ' GLU . 39.9 t80 -137.66 138.29 23.9 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.33 72.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.776 0 C-N-CA 122.863 2.375 . . . . 0.0 112.337 178.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.59 ' N ' ' O ' ' A' ' 45' ' ' TYR . 17.3 pt-20 -173.06 143.45 1.15 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.393 -0.817 . . . . 0.0 109.313 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -125.2 149.61 47.78 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.678 0.752 . . . . 0.0 109.832 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -137.77 131.3 31.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.609 0.719 . . . . 0.0 109.6 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -74.1 -16.4 61.02 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -96.6 130.56 43.77 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.791 0.805 . . . . 0.0 109.443 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.509 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 83.3 tt0 -69.02 -37.36 78.6 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.262 0.553 . . . . 0.0 110.397 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.84 95.1 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.188 -0.945 . . . . 0.0 109.649 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.96 -39.84 95.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.538 -0.726 . . . . 0.0 109.432 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.79 -40.02 94.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.531 -0.731 . . . . 0.0 109.788 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.05 -48.43 68.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.441 -0.787 . . . . 0.0 110.016 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.8 ttp85 -64.11 -44.55 91.92 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.766 0.793 . . . . 0.0 109.767 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.37 -41.9 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.579 -0.7 . . . . 0.0 109.659 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.3 p -57.9 -40.15 79.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.46 -0.775 . . . . 0.0 109.681 -179.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.17 -44.17 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 109.244 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.72 82.55 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.68 0.752 . . . . 0.0 109.405 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.512 ' SG ' ' N ' ' A' ' 63' ' ' ALA . 1.2 p -66.13 -36.96 84.51 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.821 0.82 . . . . 0.0 109.373 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.512 ' N ' ' SG ' ' A' ' 62' ' ' CYS . . . -60.89 -44.83 96.58 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.528 0.68 . . . . 0.0 109.473 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.96 -42.51 97.26 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.607 0.718 . . . . 0.0 109.513 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.48 -43.18 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.555 -0.716 . . . . 0.0 109.736 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.78 -43.22 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.353 -0.842 . . . . 0.0 109.652 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.4 -44.12 98.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.576 -0.703 . . . . 0.0 109.432 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -67.8 -40.54 83.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.358 -0.838 . . . . 0.0 109.314 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.8 m -63.43 -42.22 98.7 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.619 -0.675 . . . . 0.0 110.098 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.75 -47.34 85.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.251 -0.905 . . . . 0.0 109.811 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.95 -41.45 95.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.523 -0.736 . . . . 0.0 109.412 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 64.4 t0 . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 109.967 -179.568 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.565 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.179 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.2 mt 60.65 0.0 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.712 0.768 . . . . 0.0 109.244 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.565 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.44 -39.71 94.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.481 -0.762 . . . . 0.0 109.458 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -69.87 -19.48 63.43 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.1 mt -94.38 1.29 55.86 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.553 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.672 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.677 0.751 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.75 135.14 54.96 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.879 0.847 . . . . 0.0 109.965 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -88.14 136.79 32.81 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.726 0.774 . . . . 0.0 110.035 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -149.8 125.02 10.1 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.748 0.785 . . . . 0.0 109.569 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.539 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 23.6 mmt85 54.18 25.8 6.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.42 0.628 . . . . 0.0 109.867 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.72 3.62 83.43 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -107.63 141.24 39.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.859 0.837 . . . . 0.0 110.307 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.6 144.85 27.64 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.8 mt -124.0 129.4 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.714 0.769 . . . . 0.0 110.013 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -129.61 96.54 26.76 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.41 159.63 32.57 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.956 2.438 . . . . 0.0 113.118 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.32 126.86 0.94 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.629 ' NE2' ' CD2' ' A' ' 24' ' ' TYR . 0.3 OUTLIER -67.81 140.74 56.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.639 -0.918 . . . . 0.0 109.987 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.596 ' N ' ' ND1' ' A' ' 15' ' ' HIS . 58.6 tt0 -165.18 150.96 9.68 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 121.815 0.817 . . . . 0.0 109.753 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.55 137.67 40.48 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.793 0.806 . . . . 0.0 109.79 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp85 -97.64 135.73 39.03 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.902 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.0 p-10 -71.86 -18.06 62.09 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.93 -42.29 97.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.699 -0.626 . . . . 0.0 109.436 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 pt -113.57 -7.59 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 51.32 51.3 17.16 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.493 0.663 . . . . 0.0 109.608 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -146.48 169.67 18.43 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.932 0.872 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.629 ' CD2' ' NE2' ' A' ' 15' ' ' HIS . 3.2 m-85 -86.51 124.23 32.6 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.746 0.784 . . . . 0.0 109.314 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.45 155.45 39.18 Favored Pre-proline 0 C--N 1.302 -1.464 0 CA-C-O 121.241 0.544 . . . . 0.0 109.713 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.4 ' CB ' ' OG ' ' A' ' 59' ' ' SER . 19.4 Cg_endo -59.33 136.66 73.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.414 2.076 . . . . 0.0 111.726 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -138.52 116.87 11.94 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.409 0.623 . . . . 0.0 109.39 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -133.52 153.99 51.19 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.727 0.775 . . . . 0.0 110.206 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.8 mt -107.94 131.18 54.81 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.732 0.777 . . . . 0.0 109.845 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 30' ' ' ILE . 89.3 mt -108.85 128.01 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 CA-C-O 121.716 0.77 . . . . 0.0 109.446 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -135.67 134.96 39.73 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.734 0.778 . . . . 0.0 109.836 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -86.83 134.87 33.51 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.751 0.786 . . . . 0.0 109.994 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 78.7 t . . . . . 0 C--N 1.301 -1.538 0 CA-C-O 121.749 0.785 . . . . 0.0 110.503 -179.498 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.24 133.4 21.06 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.445 2.096 . . . . 0.0 112.349 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 35.5 mm -115.9 84.48 13.25 Favored Pre-proline 0 N--CA 1.495 1.803 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -70.32 144.57 51.45 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 122.539 2.159 . . . . 0.0 112.55 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.7 t -105.39 135.27 47.08 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.902 0.858 . . . . 0.0 109.757 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 166.73 22.37 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.701 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.456 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.1 OUTLIER -126.03 146.93 57.4 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -70.62 -12.08 30.71 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 122.628 2.218 . . . . 0.0 111.513 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -78.01 -178.1 5.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.607 -0.683 . . . . 0.0 110.021 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -130.44 147.58 52.16 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.903 0.859 . . . . 0.0 109.984 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -149.34 98.24 2.77 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.615 0.722 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -71.26 -17.3 62.49 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.1 mt -91.27 132.34 36.2 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.807 0.813 . . . . 0.0 109.754 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -67.83 -39.51 83.89 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.8 75.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.683 -0.636 . . . . 0.0 109.927 -179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.84 -38.67 91.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.536 -0.728 . . . . 0.0 109.236 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.402 ' O ' ' OG ' ' A' ' 59' ' ' SER . . . -61.64 -41.92 98.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.754 -0.591 . . . . 0.0 109.419 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -68.14 -47.09 69.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.747 -0.596 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -64.51 -44.05 92.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.604 -0.685 . . . . 0.0 109.665 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.7 t -67.76 -40.74 84.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.682 -0.636 . . . . 0.0 109.344 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 55' ' ' ALA . 64.1 m -54.47 -44.81 72.92 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.543 -0.723 . . . . 0.0 109.684 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.596 -0.69 . . . . 0.0 109.375 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.19 95.02 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.767 -0.583 . . . . 0.0 109.757 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.456 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 86.5 m -67.6 -49.4 63.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.515 -0.741 . . . . 0.0 109.602 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.38 15.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.642 -0.661 . . . . 0.0 109.585 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -65.23 -41.22 94.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.735 -0.603 . . . . 0.0 109.445 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.52 -43.75 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.619 -0.676 . . . . 0.0 109.948 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.03 -44.63 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.99 -44.54 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.602 -0.687 . . . . 0.0 109.449 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.539 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 93.0 m-20 -66.32 -43.73 85.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.473 -0.767 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.3 p -65.78 -37.46 86.38 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.672 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 84.9 t60 -58.48 -40.71 83.49 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.2 mt -63.84 -41.44 97.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.735 -0.603 . . . . 0.0 109.422 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 N--CA 1.495 1.787 0 O-C-N 121.652 -0.655 . . . . 0.0 109.742 -179.642 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.672 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 86.6 mt -95.83 12.1 31.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.339 -1.095 . . . . 0.0 108.801 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.73 -39.58 94.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.775 -0.578 . . . . 0.0 109.49 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -65.38 -35.72 81.82 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.477 -0.764 . . . . 0.0 109.0 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 87.2 mt -86.22 -5.2 59.24 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.806 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 -179.687 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.313 0.578 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.89 163.71 13.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.109 -0.995 . . . . 0.0 109.528 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -118.65 144.47 46.15 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.677 -0.64 . . . . 0.0 109.471 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -153.04 119.85 5.71 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.276 -0.89 . . . . 0.0 109.713 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 52.28 31.06 8.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.468 -0.77 . . . . 0.0 110.151 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.67 3.32 83.84 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 120.142 -1.028 . . . . 0.0 110.663 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -106.26 136.26 46.3 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.238 -1.154 . . . . 0.0 109.52 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -91.17 145.64 24.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.273 -0.892 . . . . 0.0 108.984 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.1 mt -118.72 128.64 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.684 -0.635 . . . . 0.0 109.709 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -123.8 94.16 46.32 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.08 162.14 32.01 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.868 1.712 . . . . 0.0 112.76 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.533 ' O ' ' ND1' ' A' ' 15' ' ' HIS . . . 179.5 -25.1 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.533 ' ND1' ' O ' ' A' ' 14' ' ' GLY . 0.1 OUTLIER 74.22 155.4 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.532 -0.981 . . . . 0.0 109.723 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -170.44 155.93 5.32 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -105.64 137.12 44.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.362 -0.836 . . . . 0.0 108.788 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -94.26 136.04 34.99 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.149 -0.97 . . . . 0.0 109.722 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 39.8 p30 -68.77 -20.69 64.36 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.478 -0.764 . . . . 0.0 109.552 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.528 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 30.4 t70 -59.29 -49.41 77.96 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.076 -1.015 . . . . 0.0 109.234 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.4 pt -105.71 -4.07 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.453 -0.78 . . . . 0.0 109.571 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 49.0 49.05 20.05 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.69 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -145.6 165.99 27.05 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.299 -0.876 . . . . 0.0 109.593 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -88.54 127.19 35.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.54 -0.725 . . . . 0.0 109.462 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.93 153.31 49.64 Favored Pre-proline 0 N--CA 1.492 1.66 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -43.45 130.97 6.99 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 121.537 1.491 . . . . 0.0 112.096 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -150.99 113.92 4.75 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -141.0 163.57 32.61 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.35 -0.844 . . . . 0.0 109.668 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.0 mt -106.26 131.42 53.51 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -115.94 132.26 65.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.618 -0.677 . . . . 0.0 109.89 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -126.02 136.96 53.57 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -96.81 124.38 40.77 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 74.1 t . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.484 -0.76 . . . . 0.0 109.79 179.839 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.02 148.3 44.76 Favored 'Trans proline' 0 C--N 1.314 -1.245 0 C-N-CA 121.391 1.394 . . . . 0.0 111.296 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.4 mm -114.02 132.82 22.5 Favored Pre-proline 0 N--CA 1.498 1.935 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -74.4 150.21 40.95 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 121.752 1.635 . . . . 0.0 112.491 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.07 131.63 49.07 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.0 p -136.55 164.86 27.19 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.632 -0.668 . . . . 0.0 109.422 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 47' ' ' GLU . 77.7 t80 -138.12 121.63 11.39 Favored Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -43.15 82.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.196 1.931 . . . . 0.0 113.288 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 45' ' ' TYR . 47.3 tp10 -168.56 151.57 5.37 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.02 148.56 30.59 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.091 -1.005 . . . . 0.0 111.574 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.47 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 66.7 m-85 -157.05 104.76 2.1 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 25.6 p-10 -74.72 -6.39 48.53 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.177 -0.952 . . . . 0.0 110.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 84.3 mt -102.74 130.32 49.66 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.053 -1.03 . . . . 0.0 110.23 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -66.35 -40.25 89.69 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.472 -0.768 . . . . 0.0 109.279 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -50.88 71.0 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.049 -1.032 . . . . 0.0 109.47 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.47 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.7 t0 -65.47 -39.2 91.7 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.12 -0.988 . . . . 0.0 109.232 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.59 98.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.818 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.31 -43.81 85.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.05 -1.031 . . . . 0.0 109.315 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpp85 -62.53 -46.66 87.39 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.274 -0.891 . . . . 0.0 109.192 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.1 t -66.8 -42.62 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.565 -0.71 . . . . 0.0 109.781 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -56.01 -41.48 74.98 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.112 -0.993 . . . . 0.0 109.696 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.97 -44.66 97.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 O-C-N 121.134 -0.979 . . . . 0.0 109.238 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.9 -41.58 82.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.37 -39.79 85.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.302 -0.874 . . . . 0.0 109.786 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.94 -44.84 82.92 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.342 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.87 -42.1 97.6 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.144 -0.973 . . . . 0.0 109.737 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.1 mt -64.06 -43.56 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.175 -0.953 . . . . 0.0 109.629 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 30.1 mm -63.29 -43.14 98.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.295 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.87 -44.82 99.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 121.173 -0.955 . . . . 0.0 109.4 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -65.78 -45.91 80.69 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.122 -0.986 . . . . 0.0 109.15 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.5 m -62.19 -39.02 91.33 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.428 -0.795 . . . . 0.0 109.75 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.406 ' CE1' ' N ' ' A' ' 79' ' ' ALA . 86.4 t60 -58.93 -50.16 75.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.121 -0.987 . . . . 0.0 110.219 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.52 -43.23 94.69 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.086 -1.009 . . . . 0.0 109.329 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 65.8 t0 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.224 -0.922 . . . . 0.0 110.12 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 mt -94.32 31.79 1.66 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.382 -1.069 . . . . 0.0 109.496 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.406 ' N ' ' CE1' ' A' ' 70' ' ' HIS . . . -61.57 -36.2 79.95 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 0.0 109.748 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.87 -38.15 87.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.119 -0.988 . . . . 0.0 109.401 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.1 mt -83.23 -2.95 56.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.155 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 117.989 -1.451 . . . . 0.0 109.549 179.994 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.92 0.867 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.06 134.19 55.06 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.855 0.836 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -81.97 146.91 29.5 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.701 0.763 . . . . 0.0 110.373 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.64 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 15.8 t80 -154.32 113.95 3.78 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.582 0.706 . . . . 0.0 109.423 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.64 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 46.57 36.1 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.684 0.754 . . . . 0.0 110.184 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.11 -20.08 38.78 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 6' ' ' TYR . 93.4 m-85 -86.76 137.37 32.49 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.379 -1.071 . . . . 0.0 110.122 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -91.99 149.23 21.65 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.466 0.65 . . . . 0.0 109.312 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 90.7 mt -122.82 132.26 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 CA-C-O 121.724 0.773 . . . . 0.0 109.435 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -120.62 88.49 43.35 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.87 147.37 81.77 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.66 2.24 . . . . 0.0 112.375 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.59 -173.72 35.22 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.507 ' CD2' ' OE2' ' A' ' 52' ' ' GLU . 53.7 p-80 -141.08 122.53 15.0 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.759 0.79 . . . . 0.0 109.964 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -154.6 155.33 34.53 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.907 0.86 . . . . 0.0 110.129 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -110.53 145.94 36.88 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.683 0.754 . . . . 0.0 110.071 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.424 ' HE ' HG22 ' A' ' 44' ' ' THR . 95.0 mtt-85 -101.32 137.67 39.35 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.703 0.763 . . . . 0.0 109.756 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -68.46 -15.27 63.49 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.717 -0.614 . . . . 0.0 109.95 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -62.83 -43.26 99.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.375 -0.828 . . . . 0.0 109.362 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.8 pt -114.96 -7.92 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.1 mmm180 55.17 44.11 28.31 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.433 0.635 . . . . 0.0 110.09 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -141.3 161.08 38.74 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.616 0.722 . . . . 0.0 110.49 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.96 128.67 34.73 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.947 0.879 . . . . 0.0 109.85 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.7 m -140.19 149.18 57.27 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -37.04 108.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.315 -1.196 0 C-N-CA 122.939 2.426 . . . . 0.0 112.387 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -104.78 119.89 40.07 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.669 0.747 . . . . 0.0 109.957 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.86 147.64 33.04 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.835 0.826 . . . . 0.0 109.577 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.8 mt -109.62 133.83 52.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.621 0.724 . . . . 0.0 109.199 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 mm -103.18 123.05 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -127.94 137.31 52.22 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.9 0.857 . . . . 0.0 110.22 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -101.89 141.56 34.56 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.899 0.857 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.8 t . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 121.952 0.882 . . . . 0.0 110.637 -179.128 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -57.92 145.34 91.56 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.487 2.125 . . . . 0.0 112.515 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -127.32 89.26 51.99 Favored Pre-proline 0 N--CA 1.493 1.676 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.39 143.05 56.08 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.702 2.268 . . . . 0.0 112.833 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.8 t -105.32 134.83 47.77 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.821 0.819 . . . . 0.0 109.831 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.424 HG22 ' HE ' ' A' ' 18' ' ' ARG . 47.0 p -141.2 167.26 22.61 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.54 0.686 . . . . 0.0 109.871 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.578 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.5 OUTLIER -128.44 146.49 60.07 Favored Pre-proline 0 N--CA 1.486 1.367 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -48.99 -37.18 36.71 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 122.058 1.839 . . . . 0.0 111.271 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -45.55 150.55 0.48 Allowed 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.798 0.808 . . . . 0.0 110.15 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -121.85 139.6 53.42 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.822 0.82 . . . . 0.0 110.045 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -141.66 111.93 6.92 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.686 0.755 . . . . 0.0 109.341 179.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.49 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 20.1 p-10 -68.32 -33.08 73.66 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.76 136.68 39.02 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.014 0.911 . . . . 0.0 109.942 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.507 ' OE2' ' CD2' ' A' ' 15' ' ' HIS . 43.6 tt0 -70.71 -37.07 73.52 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.765 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.71 -39.19 93.28 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.556 -0.715 . . . . 0.0 110.326 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -65.16 -38.97 92.25 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.45 -0.781 . . . . 0.0 109.362 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.91 89.19 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.614 -0.679 . . . . 0.0 109.819 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -66.85 -47.64 71.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.472 -0.768 . . . . 0.0 109.768 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -66.17 -44.1 85.03 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 121.47 0.652 . . . . 0.0 109.865 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.5 t -66.98 -41.28 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 109.575 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.0 p -57.87 -39.47 77.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.573 -0.704 . . . . 0.0 109.715 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.0 -45.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.62 -39.18 77.34 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.497 0.665 . . . . 0.0 109.764 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.578 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 5.9 t -70.92 -37.36 72.9 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.478 -0.764 . . . . 0.0 109.662 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.86 87.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.69 -0.631 . . . . 0.0 109.711 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -64.02 -42.93 96.96 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.563 0.697 . . . . 0.0 109.293 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.3 mt -65.36 -43.51 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.647 -0.658 . . . . 0.0 109.642 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -64.22 -44.18 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 110.104 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.2 mt -65.1 -43.68 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.642 -0.661 . . . . 0.0 109.306 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -66.24 -43.65 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.628 -0.67 . . . . 0.0 109.456 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.0 p -68.27 -36.66 79.74 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.56 0.695 . . . . 0.0 109.435 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -61.27 -45.29 95.1 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.628 -0.67 . . . . 0.0 109.76 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 81.3 mt -64.65 -42.91 95.09 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.468 0.651 . . . . 0.0 109.639 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.97 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.98 25.96 10.72 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.716 -0.873 . . . . 0.0 109.64 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.12 79.55 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.353 -0.842 . . . . 0.0 109.426 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.5 -40.81 97.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.445 0.64 . . . . 0.0 109.64 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -84.84 -2.56 57.91 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -179.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.839 0.828 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.44 155.34 17.92 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.546 -0.721 . . . . 0.0 109.509 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -109.52 141.39 42.05 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.71 0.767 . . . . 0.0 109.947 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -153.69 122.59 6.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.41 -0.806 . . . . 0.0 109.21 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 54.83 25.91 7.17 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.634 0.73 . . . . 0.0 110.083 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.48 8.37 77.55 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -110.84 142.94 42.18 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.349 -1.089 . . . . 0.0 110.292 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -91.91 142.34 27.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.407 -0.808 . . . . 0.0 109.438 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.432 HD13 HG22 ' A' ' 11' ' ' ILE . 96.7 mt -123.13 130.62 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.511 -0.743 . . . . 0.0 109.591 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -120.83 94.22 48.87 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -78.26 148.6 24.2 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.608 2.205 . . . . 0.0 113.101 -178.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.78 115.04 0.39 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -55.18 136.91 48.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -1.038 . . . . 0.0 111.034 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -153.59 149.29 27.46 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.467 -0.771 . . . . 0.0 109.32 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -106.78 134.32 50.11 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.858 0.837 . . . . 0.0 110.119 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 94.2 mtt180 -94.13 138.19 32.47 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.538 -0.726 . . . . 0.0 109.786 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -68.66 -20.74 64.47 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.531 -0.731 . . . . 0.0 109.434 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.83 -43.68 95.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.904 . . . . 0.0 109.784 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.417 HD11 HG23 ' A' ' 21' ' ' ILE . 15.1 pt -112.12 -0.31 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' ARG . 90.2 mtm-85 43.28 37.2 1.22 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.64 -0.662 . . . . 0.0 110.401 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -137.48 162.56 33.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.253 -0.905 . . . . 0.0 110.172 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -86.12 128.57 34.9 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.843 0.83 . . . . 0.0 109.85 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.5 m -145.84 147.63 33.16 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -37.27 110.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.707 2.272 . . . . 0.0 112.17 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -119.58 118.42 30.96 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.38 -0.825 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.1 155.0 44.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.312 -0.868 . . . . 0.0 109.179 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -111.08 130.28 55.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.731 . . . . 0.0 109.254 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.417 HD13 HG21 ' A' ' 30' ' ' ILE . 98.1 mt -107.11 130.65 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -134.81 138.51 44.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.501 -0.75 . . . . 0.0 109.048 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.53 137.48 32.3 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -0.812 . . . . 0.0 110.196 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 76.7 t . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 121.692 0.758 . . . . 0.0 110.39 -179.698 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.6 m . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -55.19 140.46 81.08 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.763 2.309 . . . . 0.0 112.035 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.88 131.05 24.04 Favored Pre-proline 0 N--CA 1.495 1.777 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.81 142.78 44.11 Favored 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.132 1.888 . . . . 0.0 112.494 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.8 t -119.22 130.22 55.36 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.642 0.734 . . . . 0.0 109.089 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -139.22 167.45 22.05 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.553 ' O ' ' N ' ' A' ' 47' ' ' GLU . 82.6 t80 -120.62 123.8 27.89 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.596 -0.69 . . . . 0.0 109.193 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -43.35 80.54 0.01 OUTLIER 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 122.576 2.184 . . . . 0.0 112.561 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 45' ' ' TYR . 81.2 tt0 -172.69 157.76 3.88 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.266 -0.896 . . . . 0.0 109.028 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -112.09 140.08 47.07 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.361 -0.837 . . . . 0.0 109.486 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.475 ' CZ ' ' OE2' ' A' ' 47' ' ' GLU . 37.7 m-85 -135.7 131.56 35.79 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.38 -0.825 . . . . 0.0 108.9 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -93.32 -23.95 18.3 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.83 137.76 32.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.068 -1.02 . . . . 0.0 110.181 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -71.13 -37.51 72.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.48 -0.762 . . . . 0.0 109.398 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.49 84.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 109.421 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.7 -41.46 98.12 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.405 -0.81 . . . . 0.0 109.506 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.2 96.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 109.981 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.85 -44.25 70.24 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.118 -0.989 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -67.68 -43.01 81.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.162 -0.961 . . . . 0.0 110.027 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.92 -42.68 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.709 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -60.35 -42.15 95.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.623 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 93.7 mt -65.52 -44.47 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.147 -0.971 . . . . 0.0 109.691 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.71 -39.3 80.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.053 -1.03 . . . . 0.0 109.211 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.8 t -69.54 -38.37 77.48 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.406 -0.809 . . . . 0.0 109.625 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.9 -46.13 85.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.48 -43.82 96.21 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.118 -0.989 . . . . 0.0 109.455 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.424 HD12 HG22 ' A' ' 65' ' ' ILE . 96.8 mt -65.57 -43.06 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.908 . . . . 0.0 109.394 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.44 -44.05 98.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.177 -0.952 . . . . 0.0 109.586 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.02 -44.48 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.216 -0.928 . . . . 0.0 109.447 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -66.4 -41.98 88.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.431 -0.793 . . . . 0.0 109.878 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.8 p -67.63 -35.73 79.47 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.237 -0.914 . . . . 0.0 109.692 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.583 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 80.9 t60 -60.64 -43.86 97.08 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.334 -0.854 . . . . 0.0 109.61 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.87 -41.78 97.69 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.863 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.17 -0.956 . . . . 0.0 110.24 -179.45 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.59 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.583 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 25.1 mt -108.36 24.85 12.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.466 -1.02 . . . . 0.0 109.476 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.86 89.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -64.58 -35.63 81.62 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.306 -0.871 . . . . 0.0 109.485 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 85.1 mt -83.27 14.74 3.33 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.217 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.517 0.675 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.8 157.35 16.18 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -0.842 . . . . 0.0 109.978 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.22 143.43 41.99 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.67 -0.644 . . . . 0.0 109.528 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -155.47 126.3 6.99 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.435 -0.791 . . . . 0.0 109.448 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 53.22 24.75 3.88 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.705 0.764 . . . . 0.0 109.615 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.63 -16.67 55.89 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -84.9 143.17 29.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -1.102 . . . . 0.0 110.49 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -90.12 143.94 26.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.468 -0.77 . . . . 0.0 109.063 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.4 HD12 HG23 ' A' ' 11' ' ' ILE . 96.5 mt -124.3 129.9 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.611 -0.68 . . . . 0.0 109.275 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -115.5 126.34 27.85 Favored Pre-proline 0 N--CA 1.492 1.663 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.93 158.45 38.54 Favored 'Trans proline' 0 N--CA 1.495 1.588 0 C-N-CA 122.351 2.034 . . . . 0.0 113.098 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.3 -176.6 45.26 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -147.79 124.53 11.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.347 -1.09 . . . . 0.0 109.015 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -146.12 157.46 43.84 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.924 . . . . 0.0 109.06 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -106.5 145.9 31.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.624 -0.672 . . . . 0.0 110.175 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.405 HH21 ' CD1' ' A' ' 21' ' ' ILE . 88.9 mtm180 -92.87 140.03 29.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.459 -0.776 . . . . 0.0 110.117 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -67.44 -28.46 67.91 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.396 -0.815 . . . . 0.0 109.534 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -60.26 -49.02 79.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.463 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.405 ' CD1' HH21 ' A' ' 18' ' ' ARG . 18.7 pt -106.29 0.03 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.493 -0.755 . . . . 0.0 109.502 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 43.19 44.71 4.55 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.413 -0.805 . . . . 0.0 109.833 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -137.92 161.41 36.72 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.397 -0.814 . . . . 0.0 110.081 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -84.32 133.41 34.54 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.572 0.701 . . . . 0.0 110.171 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.6 155.25 41.77 Favored Pre-proline 0 N--CA 1.487 1.395 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -42.42 120.47 1.68 Allowed 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 122.167 1.911 . . . . 0.0 111.9 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -126.18 127.98 46.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.704 -0.623 . . . . 0.0 109.747 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -150.99 157.69 43.19 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.307 -0.871 . . . . 0.0 109.2 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 86.0 mt -106.63 135.34 48.32 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -117.35 132.03 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.82 -0.55 . . . . 0.0 109.809 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -131.84 138.6 48.55 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.5 0.667 . . . . 0.0 109.403 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -83.48 135.97 34.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.513 -0.742 . . . . 0.0 110.058 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.3 t . . . . . 0 N--CA 1.489 1.485 0 O-C-N 121.421 -0.8 . . . . 0.0 110.045 -179.78 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.42 ' O ' ' OD2' ' A' ' 80' ' ' ASP . 9.8 m . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.05 146.05 28.63 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 121.957 1.771 . . . . 0.0 112.52 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.7 mm -115.07 93.74 36.11 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.25 140.64 51.54 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.13 1.887 . . . . 0.0 112.068 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 t -99.03 136.14 39.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.422 -0.799 . . . . 0.0 109.631 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -132.47 161.06 34.69 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.541 ' O ' ' O ' ' A' ' 46' ' ' PRO . 4.4 t80 -142.03 140.62 19.87 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 45' ' ' TYR . 76.7 Cg_exo -46.24 -131.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.974 2.449 . . . . 0.0 113.39 178.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' PRO . 58.8 mp0 44.29 -170.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.097 -1.002 . . . . 0.0 110.468 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 49' ' ' TYR . 71.2 m-85 -145.7 149.3 34.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.145 -0.972 . . . . 0.0 109.8 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.413 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 64.1 m-85 -146.9 105.94 3.87 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.475 -0.766 . . . . 0.0 109.133 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -72.65 -17.59 61.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.4 mt -96.53 126.73 41.92 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.81 0.814 . . . . 0.0 109.92 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -69.37 -38.06 77.87 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.457 0.646 . . . . 0.0 109.811 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -46.63 87.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.369 -0.832 . . . . 0.0 109.745 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -65.2 -36.03 82.9 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.486 -0.759 . . . . 0.0 109.475 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.418 ' O ' ' OG ' ' A' ' 59' ' ' SER . . . -63.33 -38.74 92.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.315 -0.866 . . . . 0.0 109.433 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.77 -48.07 78.41 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.883 . . . . 0.0 109.594 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -46.1 89.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 109.289 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.8 t -64.0 -42.69 96.5 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.729 -0.607 . . . . 0.0 109.524 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 55' ' ' ALA . 45.6 m -55.25 -39.94 70.36 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.079 -1.013 . . . . 0.0 109.566 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.412 HD12 HG22 ' A' ' 60' ' ' ILE . 97.2 mt -64.03 -44.99 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 120.96 -1.088 . . . . 0.0 109.098 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.92 79.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.9 . . . . 0.0 109.737 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.5 m -66.75 -38.29 86.32 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.286 -0.884 . . . . 0.0 109.172 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.8 -43.57 77.0 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.405 -0.809 . . . . 0.0 109.212 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -62.84 -42.17 99.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.105 -0.997 . . . . 0.0 109.532 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.07 -43.44 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.43 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.63 -43.57 98.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.297 -0.877 . . . . 0.0 109.591 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.23 -45.15 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.035 -1.04 . . . . 0.0 109.557 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.83 -41.69 97.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 t -65.95 -37.91 87.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.289 -0.882 . . . . 0.0 109.425 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.614 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 81.7 t60 -56.39 -45.12 80.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.217 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.13 -38.48 90.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.363 -0.836 . . . . 0.0 109.543 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 63.5 t0 . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.884 -179.485 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.474 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.614 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 42.8 mt -111.01 31.77 5.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.48 -1.011 . . . . 0.0 109.462 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.44 -36.67 84.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.902 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.42 ' OD2' ' O ' ' A' ' 39' ' ' THR . 21.3 p-10 -59.6 -45.84 90.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 109.893 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.52 -41.45 96.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 0.0 110.197 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 CA-C-O 117.87 -1.517 . . . . 0.0 109.574 -179.642 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.849 0.833 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.43 160.33 14.85 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.67 0.747 . . . . 0.0 110.094 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -108.0 147.17 31.47 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.778 0.799 . . . . 0.0 109.812 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -151.71 119.11 5.99 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.864 0.84 . . . . 0.0 110.051 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.434 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.7 mtp180 45.85 32.09 1.21 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.441 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.22 -23.03 35.33 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -84.03 141.47 31.15 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.516 -0.99 . . . . 0.0 110.317 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -94.3 140.08 30.25 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.742 0.782 . . . . 0.0 109.697 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.406 HD12 HG23 ' A' ' 11' ' ' ILE . 96.8 mt -116.75 128.89 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.678 0.752 . . . . 0.0 109.719 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -123.97 96.49 42.46 Favored Pre-proline 0 N--CA 1.492 1.645 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.13 154.7 37.47 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 122.874 2.383 . . . . 0.0 112.689 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.8 95.75 0.11 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -47.43 146.74 1.93 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.791 -0.829 . . . . 0.0 109.919 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -146.98 157.99 43.79 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.872 0.844 . . . . 0.0 109.799 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -101.34 119.94 39.52 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.733 0.777 . . . . 0.0 109.615 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -95.78 137.86 34.25 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.828 0.823 . . . . 0.0 110.001 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.94 -24.3 41.12 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -62.6 -44.81 95.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.59 -0.693 . . . . 0.0 109.626 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.3 pt -106.98 1.27 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.46 -0.775 . . . . 0.0 109.279 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 42.95 39.59 1.83 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.594 0.711 . . . . 0.0 109.689 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HG3' ' H ' ' A' ' 24' ' ' TYR . 29.4 tptt -145.88 161.46 39.96 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.774 0.797 . . . . 0.0 110.21 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.415 ' H ' ' HG3' ' A' ' 23' ' ' LYS . 95.7 m-85 -85.96 132.7 34.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.916 0.865 . . . . 0.0 109.449 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.6 m -148.1 148.44 29.55 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.796 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.47 110.42 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.745 2.296 . . . . 0.0 111.868 178.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.8 121.44 40.8 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.812 0.815 . . . . 0.0 109.837 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.03 154.11 43.65 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.692 0.758 . . . . 0.0 109.995 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.4 mt -111.4 129.43 56.02 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.695 0.759 . . . . 0.0 109.321 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.426 HD12 HG22 ' A' ' 30' ' ' ILE . 96.7 mt -108.81 130.22 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.712 0.768 . . . . 0.0 109.813 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -130.57 130.83 44.56 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.847 0.832 . . . . 0.0 109.704 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -84.76 135.87 33.94 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.841 0.829 . . . . 0.0 109.837 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 73.1 t . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 121.754 0.788 . . . . 0.0 110.124 -179.781 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.484 1.255 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 147.32 34.2 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.367 2.045 . . . . 0.0 112.531 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -114.23 126.49 27.93 Favored Pre-proline 0 N--CA 1.487 1.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -74.99 145.54 31.62 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 C-N-CA 122.427 2.085 . . . . 0.0 112.333 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.87 130.73 53.23 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.866 0.841 . . . . 0.0 109.575 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.9 p -141.07 167.42 22.24 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.713 0.768 . . . . 0.0 109.568 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.504 ' O ' ' N ' ' A' ' 47' ' ' GLU . 55.3 t80 -123.88 126.84 25.59 Favored Pre-proline 0 N--CA 1.488 1.448 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -46.28 83.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 122.446 2.097 . . . . 0.0 112.251 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 45' ' ' TYR . 45.2 tp10 -170.79 147.6 2.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 109.374 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -109.88 127.52 54.77 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.607 0.718 . . . . 0.0 109.686 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.05 133.5 54.32 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.979 0.895 . . . . 0.0 109.778 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -87.09 -24.31 24.61 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -103.72 132.53 49.89 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.974 0.892 . . . . 0.0 109.732 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.603 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 1.1 pm0 -68.83 -34.86 76.19 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.39 -47.68 72.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.667 -0.646 . . . . 0.0 109.323 -179.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -65.21 -37.58 87.73 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.575 -0.703 . . . . 0.0 109.371 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.407 ' O ' ' OG ' ' A' ' 59' ' ' SER . . . -66.7 -36.45 82.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.735 -0.603 . . . . 0.0 109.566 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.61 -51.42 67.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.708 -0.62 . . . . 0.0 109.616 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -63.66 -43.47 96.63 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.393 0.616 . . . . 0.0 109.53 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.5 t -64.96 -39.61 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 55' ' ' ALA . 69.3 m -55.89 -43.14 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.578 -0.701 . . . . 0.0 109.519 -179.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.18 -45.88 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.602 -0.686 . . . . 0.0 109.593 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.87 -36.82 80.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.545 -0.722 . . . . 0.0 109.293 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -65.8 -49.44 68.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.647 -0.658 . . . . 0.0 109.732 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.44 -39.77 64.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.736 -0.602 . . . . 0.0 109.661 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -39.82 94.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.71 -0.619 . . . . 0.0 109.688 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.68 -43.97 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.67 -0.644 . . . . 0.0 109.855 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.36 -43.54 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.528 -0.732 . . . . 0.0 109.462 -179.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.2 mt -63.7 -44.71 98.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.434 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 97.2 m-20 -69.99 -44.77 68.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.429 0.633 . . . . 0.0 109.77 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.1 t -65.7 -42.02 91.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.666 -0.646 . . . . 0.0 109.781 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -59.24 -44.75 92.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.641 -0.662 . . . . 0.0 109.468 -179.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.2 -43.08 96.15 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.645 -0.66 . . . . 0.0 110.025 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.497 -0.752 . . . . 0.0 109.062 179.957 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.521 0 N-CA-C 108.934 -1.667 . . . . 0.0 108.934 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.5 mt -100.35 21.34 13.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.581 -0.952 . . . . 0.0 108.456 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.34 98.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.931 -0.48 . . . . 0.0 109.944 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.86 -35.83 81.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.682 -0.636 . . . . 0.0 109.547 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.2 mt -85.1 -6.26 59.31 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 109.5 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.675 0 CA-C-O 117.952 -1.471 . . . . 0.0 109.729 -179.774 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 121.301 0.572 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.86 133.28 53.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.563 -0.711 . . . . 0.0 109.525 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -83.34 135.17 34.82 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.413 -0.804 . . . . 0.0 109.971 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -144.0 117.86 9.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.347 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.411 ' HE ' ' CD1' ' A' ' 71' ' ' LEU . 78.5 mtp85 53.85 29.15 9.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.551 -0.718 . . . . 0.0 109.758 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.09 -4.56 83.04 Favored Glycine 0 N--CA 1.494 2.531 0 N-CA-C 110.199 -1.161 . . . . 0.0 110.199 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -105.89 134.44 49.02 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.456 -1.026 . . . . 0.0 109.935 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.89 144.6 25.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 109.091 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 78.8 mt -120.19 136.45 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.249 0.547 . . . . 0.0 109.628 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -121.56 85.61 43.71 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -61.48 150.22 86.17 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.858 2.372 . . . . 0.0 112.536 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.566 ' O ' ' CG ' ' A' ' 15' ' ' HIS . . . -174.01 -9.1 0.02 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.566 ' CG ' ' O ' ' A' ' 14' ' ' GLY . 3.9 p-80 56.57 153.34 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.785 -0.832 . . . . 0.0 110.571 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -169.24 153.11 5.23 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.494 -0.754 . . . . 0.0 109.059 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -98.99 137.49 37.45 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.537 -0.727 . . . . 0.0 109.649 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -92.19 135.95 33.58 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.582 -0.699 . . . . 0.0 109.593 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.47 -19.95 63.75 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.51 -0.744 . . . . 0.0 109.504 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -62.95 -44.65 95.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.477 -0.765 . . . . 0.0 109.88 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.2 pt -109.71 2.76 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.666 -0.646 . . . . 0.0 109.289 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 43.44 43.05 4.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.626 -0.672 . . . . 0.0 109.438 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.8 tptm -139.39 164.46 29.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.409 -0.807 . . . . 0.0 109.732 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -85.1 129.97 34.7 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.734 -0.604 . . . . 0.0 109.765 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -150.17 155.17 37.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.378 -0.826 . . . . 0.0 108.998 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -43.47 135.83 6.41 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.198 1.932 . . . . 0.0 112.693 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE2' ' CB ' ' A' ' 42' ' ' PRO . 48.7 t80 -153.5 114.47 4.1 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.39 152.35 49.55 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.388 -0.82 . . . . 0.0 109.706 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.05 129.62 44.89 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.431 HG22 HD12 ' A' ' 30' ' ' ILE . 97.4 mt -115.83 131.41 68.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.627 -0.671 . . . . 0.0 110.035 -179.041 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -132.9 145.74 51.19 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.586 -0.696 . . . . 0.0 109.21 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -82.62 128.23 34.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.211 -0.93 . . . . 0.0 109.797 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.4 t . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.566 -0.709 . . . . 0.0 110.165 -179.684 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.9 m . . . . . 0 N--CA 1.496 1.85 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -75.45 146.86 31.58 Favored 'Trans proline' 0 N--CA 1.493 1.499 0 C-N-CA 122.197 1.932 . . . . 0.0 113.024 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -134.35 90.69 24.21 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.479 ' CB ' ' CE2' ' A' ' 27' ' ' TYR . 48.3 Cg_exo -54.72 144.75 63.7 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.319 2.013 . . . . 0.0 111.87 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 t -99.67 136.14 40.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.581 -0.699 . . . . 0.0 109.227 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -136.56 157.52 46.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -139.31 101.35 7.54 Favored Pre-proline 0 N--CA 1.492 1.64 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.2 107.14 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 121.825 1.683 . . . . 0.0 112.475 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 48' ' ' PHE . 54.6 mt-10 -150.66 -13.13 0.24 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.436 ' O ' ' O ' ' A' ' 47' ' ' GLU . 1.6 m-85 54.24 108.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.238 0.542 . . . . 0.0 110.1 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -131.54 132.86 44.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.582 -0.699 . . . . 0.0 109.417 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -87.24 -22.11 25.41 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.736 . . . . 0.0 109.316 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -91.12 133.08 35.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.466 -0.771 . . . . 0.0 110.659 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -67.62 -38.02 83.33 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.55 -40.45 91.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 109.759 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.75 -43.3 99.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.433 -0.792 . . . . 0.0 109.817 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.48 96.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.453 -0.78 . . . . 0.0 110.034 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -66.91 -49.44 65.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.401 -0.812 . . . . 0.0 109.911 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -65.99 -43.65 87.18 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.514 -0.741 . . . . 0.0 109.653 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.11 -42.65 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.603 -0.686 . . . . 0.0 109.532 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -58.09 -42.23 85.18 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.458 -0.777 . . . . 0.0 109.87 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.81 -44.85 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.139 -0.975 . . . . 0.0 109.372 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.06 -44.36 80.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.502 -0.749 . . . . 0.0 109.485 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.1 m -65.86 -43.62 87.83 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.583 -0.698 . . . . 0.0 109.265 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -50.17 -42.91 51.96 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -63.31 -43.01 99.03 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.489 -0.757 . . . . 0.0 109.302 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.429 HG22 HD13 ' A' ' 65' ' ' ILE . 94.6 mt -64.12 -44.75 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.375 -0.828 . . . . 0.0 109.774 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -66.04 -45.93 89.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.376 -0.828 . . . . 0.0 109.138 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.8 mt -64.75 -44.65 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.485 -0.759 . . . . 0.0 109.629 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -68.52 -46.35 69.8 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.538 -0.727 . . . . 0.0 109.87 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.6 m -62.63 -42.15 99.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.568 -0.708 . . . . 0.0 110.094 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -59.16 -42.34 90.51 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.754 . . . . 0.0 109.674 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.411 ' CD1' ' HE ' ' A' ' 7' ' ' ARG . 81.9 mt -64.88 -36.0 82.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.588 -0.695 . . . . 0.0 109.719 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.854 . . . . 0.0 109.626 -179.534 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.6 mt -101.91 17.87 22.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.536 -0.979 . . . . 0.0 109.521 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.93 -38.68 89.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.393 -0.817 . . . . 0.0 109.48 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.85 -37.28 86.79 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.524 -0.735 . . . . 0.0 109.835 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 54.2 mt -83.38 -3.14 57.24 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.354 -0.841 . . . . 0.0 109.121 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.3 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -76.67 151.94 35.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.486 -0.759 . . . . 0.0 110.13 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m -72.37 140.62 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.604 -0.685 . . . . 0.0 109.887 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.76 140.62 32.68 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.267 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -83.19 149.85 26.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.0 110.267 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.406 ' N ' ' O ' ' A' ' 9' ' ' TYR . 88.1 t80 -153.54 115.04 4.2 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.409 -0.807 . . . . 0.0 109.327 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.472 HH12 ' CD1' ' A' ' 71' ' ' LEU . 20.7 mtp-105 52.07 30.18 7.22 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 109.921 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.68 -1.87 81.82 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.406 ' O ' ' N ' ' A' ' 6' ' ' TYR . 95.4 m-85 -106.73 141.93 37.19 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.373 -1.075 . . . . 0.0 109.761 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -89.72 146.1 24.74 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.524 -0.735 . . . . 0.0 109.491 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -121.59 136.52 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -119.18 87.68 35.46 Favored Pre-proline 0 N--CA 1.496 1.857 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.11 146.05 95.68 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.524 2.149 . . . . 0.0 112.204 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.54 -167.72 39.37 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -148.48 142.9 26.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.283 -1.127 . . . . 0.0 109.535 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -161.85 150.57 15.48 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -109.09 143.5 38.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.476 -0.765 . . . . 0.0 109.66 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -99.47 139.11 35.61 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 121.529 0.68 . . . . 0.0 109.83 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.26 -20.24 64.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.442 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.92 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.154 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.5 pt -109.63 0.02 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 42.12 39.64 1.44 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.785 -0.572 . . . . 0.0 109.868 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -140.5 161.45 37.7 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.285 -0.885 . . . . 0.0 109.825 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -85.73 130.86 34.45 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.429 0.633 . . . . 0.0 109.854 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.98 146.85 32.58 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.45 -0.781 . . . . 0.0 109.338 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -37.72 111.55 0.1 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 122.571 2.181 . . . . 0.0 112.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -121.57 117.33 26.5 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -142.15 159.0 43.11 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.193 -0.942 . . . . 0.0 109.592 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 53.8 mt -113.6 134.47 54.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.638 -0.664 . . . . 0.0 109.238 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.42 HD12 HG21 ' A' ' 30' ' ' ILE . 94.9 mt -111.92 133.1 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.681 -0.637 . . . . 0.0 109.53 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -127.32 130.63 49.84 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -83.4 138.64 33.41 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.646 0.736 . . . . 0.0 110.326 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.5 t -64.44 -42.51 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.718 -0.614 . . . . 0.0 109.939 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.82 -36.39 93.24 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.635 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.1 m -150.54 73.17 9.0 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 120.855 -1.379 . . . . 0.0 109.795 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -77.47 -9.61 17.4 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.405 2.07 . . . . 0.0 111.125 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -76.0 -6.29 50.3 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.578 -0.701 . . . . 0.0 109.128 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -78.68 147.46 33.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.394 -0.817 . . . . 0.0 109.965 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.8 m -44.9 131.15 5.27 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.25 151.92 44.11 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.887 1.725 . . . . 0.0 111.882 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 38.6 mm -115.48 100.21 53.33 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.57 136.2 41.13 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 121.897 1.731 . . . . 0.0 112.483 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 p -95.27 134.97 37.45 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.7 p -138.01 167.16 22.36 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -148.89 141.68 15.42 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.178 -0.951 . . . . 0.0 108.929 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.56 86.33 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.88 1.72 . . . . 0.0 112.226 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -176.4 169.5 2.66 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.499 -0.751 . . . . 0.0 108.98 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -130.7 146.91 52.3 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.418 -0.801 . . . . 0.0 109.413 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.505 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 27.9 m-85 -141.81 123.46 15.1 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.356 -0.84 . . . . 0.0 109.589 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.16 -33.25 67.57 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.355 0.598 . . . . 0.0 109.701 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -89.45 133.12 34.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.805 . . . . 0.0 110.538 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -69.57 -36.04 75.91 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.452 0.644 . . . . 0.0 109.476 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.58 91.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.506 -0.746 . . . . 0.0 109.515 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.505 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 58.0 t0 -63.09 -38.01 89.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.378 -0.826 . . . . 0.0 109.051 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.41 -36.64 84.81 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.493 -0.754 . . . . 0.0 109.639 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.53 -49.48 75.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 109.731 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.63 -42.77 95.27 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.272 -0.892 . . . . 0.0 109.444 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.5 t -65.22 -42.78 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.564 -0.71 . . . . 0.0 109.631 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 98.1 p -56.62 -39.39 73.55 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.411 -0.805 . . . . 0.0 109.676 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.406 HD11 HG22 ' A' ' 60' ' ' ILE . 95.1 mt -63.84 -45.29 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 109.296 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.71 82.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.339 -0.851 . . . . 0.0 109.423 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.56 -46.15 76.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.468 -0.77 . . . . 0.0 109.5 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.13 73.99 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.369 -0.832 . . . . 0.0 109.452 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.42 -43.96 95.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.301 -0.874 . . . . 0.0 109.365 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.37 -44.38 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.433 -0.792 . . . . 0.0 110.104 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 32.7 mm -64.17 -44.38 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.157 -0.964 . . . . 0.0 109.404 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 94.7 mt -64.38 -45.66 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.159 -0.963 . . . . 0.0 109.506 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.28 -46.36 77.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.338 -0.852 . . . . 0.0 109.635 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.486 ' O ' ' N ' ' A' ' 73' ' ' ARG . 19.2 m -63.15 -37.91 89.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.546 -0.721 . . . . 0.0 109.85 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -59.78 -47.9 83.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.631 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.472 ' CD1' HH12 ' A' ' 7' ' ' ARG . 90.6 mt -64.18 -42.8 96.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.348 -0.845 . . . . 0.0 109.871 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -83.37 -67.59 0.78 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.319 -0.863 . . . . 0.0 110.33 -179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.486 ' N ' ' O ' ' A' ' 69' ' ' SER . 80.7 mtp85 -84.43 142.91 29.77 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.383 -0.823 . . . . 0.0 110.213 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.75 66.88 9.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.563 -0.71 . . . . 0.0 109.087 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -79.58 -3.11 45.51 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? 54.31 93.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.548 0.69 . . . . 0.0 109.892 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -152.87 -65.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.18 30.55 1.23 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.275 -1.133 . . . . 0.0 109.305 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.15 -35.81 81.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.648 -0.658 . . . . 0.0 109.308 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' A' ' 80' ' ' ASP . 23.1 p-10 -64.69 -31.88 73.3 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.481 -0.762 . . . . 0.0 109.625 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.35 -3.29 57.36 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.326 -0.859 . . . . 0.0 109.471 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.68 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.467 0.651 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -88.14 110.71 20.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.378 -0.827 . . . . 0.0 109.607 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.2 m -84.75 150.83 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 109.98 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.28 140.82 47.67 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.575 -0.703 . . . . 0.0 109.433 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.9 m170 -85.13 154.13 22.23 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.401 -0.812 . . . . 0.0 110.307 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.665 ' HH ' HH12 ' A' ' 7' ' ' ARG . 20.6 t80 -153.3 111.43 3.62 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.328 -0.857 . . . . 0.0 109.044 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.665 HH12 ' HH ' ' A' ' 6' ' ' TYR . 83.8 mtt85 47.41 31.86 2.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.539 -0.726 . . . . 0.0 110.102 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.34 -20.74 47.98 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -85.4 138.42 32.27 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -1.067 . . . . 0.0 110.107 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.31 139.13 31.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.626 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.0 mt -121.29 130.42 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -121.93 87.94 47.31 Favored Pre-proline 0 N--CA 1.496 1.837 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -57.82 144.97 92.56 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 122.697 2.264 . . . . 0.0 112.506 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.91 98.19 0.11 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -49.01 155.82 0.58 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.434 -1.039 . . . . 0.0 110.793 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -154.87 157.87 38.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.39 -0.819 . . . . 0.0 109.051 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -99.96 120.66 40.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.593 -0.692 . . . . 0.0 109.396 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.581 ' NH1' ' HG1' ' A' ' 44' ' ' THR . 84.4 mtp180 -102.04 138.58 38.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.601 -0.687 . . . . 0.0 109.964 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.22 -17.03 58.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.554 -0.716 . . . . 0.0 109.404 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -59.64 -49.54 77.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.222 -0.924 . . . . 0.0 109.652 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 pt -107.9 0.27 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 50.33 34.93 9.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.643 -0.661 . . . . 0.0 109.582 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -140.44 174.42 10.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.366 -0.834 . . . . 0.0 110.217 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -93.72 130.29 39.74 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.534 0.683 . . . . 0.0 109.954 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' O ' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -143.17 155.63 61.68 Favored Pre-proline 0 N--CA 1.492 1.632 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -55.37 110.19 0.52 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.211 1.941 . . . . 0.0 111.85 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -114.68 117.54 31.12 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -132.52 147.94 52.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.581 -0.699 . . . . 0.0 109.534 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -93.3 128.33 39.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.539 -0.726 . . . . 0.0 109.474 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.3 mt -110.01 127.5 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -132.0 133.27 44.26 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.582 -0.699 . . . . 0.0 109.395 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.42 125.6 40.15 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.661 0.744 . . . . 0.0 109.562 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.7 t -60.19 136.9 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.533 0.682 . . . . 0.0 110.694 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.47 -13.25 61.41 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.8 m -152.48 77.53 6.57 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.159 -1.201 . . . . 0.0 109.77 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -76.25 -9.49 19.04 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 122.476 2.117 . . . . 0.0 111.07 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.632 ' C ' ' H ' ' A' ' 39' ' ' THR . 71.0 m-20 -86.7 -145.49 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.63 -0.669 . . . . 0.0 109.957 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 57.8 -0.84 0.09 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.442 0.639 . . . . 0.0 110.079 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.632 ' H ' ' C ' ' A' ' 37' ' ' ASP . 2.7 m 74.18 132.3 0.04 OUTLIER Pre-proline 0 C--N 1.296 -1.73 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.168 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.34 153.95 70.11 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.006 1.804 . . . . 0.0 112.272 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.6 mm -122.34 88.87 49.07 Favored Pre-proline 0 N--CA 1.494 1.732 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -55.25 146.6 59.81 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.662 2.241 . . . . 0.0 112.539 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.78 135.79 40.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.569 -0.707 . . . . 0.0 109.587 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.581 ' HG1' ' NH1' ' A' ' 18' ' ' ARG . 32.0 p -136.21 167.93 20.36 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -136.2 136.62 22.94 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.99 86.82 1.06 Allowed 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 121.974 1.783 . . . . 0.0 112.119 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.472 ' O ' ' CG1' ' A' ' 25' ' ' VAL . 8.9 tt0 -168.54 -173.35 1.9 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 109.213 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -133.69 121.17 21.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.609 -0.682 . . . . 0.0 109.26 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.537 ' C ' ' H ' ' A' ' 51' ' ' LEU . 91.8 m-85 -111.79 -36.88 5.31 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.9 t0 58.87 -0.3 0.14 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.775 -0.578 . . . . 0.0 109.925 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.8 mt -118.03 126.67 52.75 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.397 -0.815 . . . . 0.0 109.638 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.95 -42.49 80.85 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.591 -0.693 . . . . 0.0 109.641 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.66 -47.93 83.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.621 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -67.0 -38.76 86.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.75 -40.98 98.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.304 -0.873 . . . . 0.0 109.216 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.87 -44.99 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.874 . . . . 0.0 109.649 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -65.63 -44.57 86.05 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.282 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.0 t -67.87 -41.4 84.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.572 -0.705 . . . . 0.0 109.418 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.4 p -56.63 -41.32 76.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.207 -0.933 . . . . 0.0 109.616 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.34 -45.0 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.055 -1.028 . . . . 0.0 109.509 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.69 -46.04 73.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.375 -0.828 . . . . 0.0 109.96 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.5 m -66.24 -49.58 66.72 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.423 -0.798 . . . . 0.0 109.495 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -45.4 -46.14 13.1 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.679 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.59 -41.87 98.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.424 HG21 HD12 ' A' ' 65' ' ' ILE . 94.4 mt -64.02 -43.93 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.152 -0.968 . . . . 0.0 109.466 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.64 -44.81 96.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -0.928 . . . . 0.0 108.621 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.07 -43.94 97.62 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 O-C-N 121.06 -1.025 . . . . 0.0 108.795 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.93 -41.82 97.53 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.317 -0.864 . . . . 0.0 109.19 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -60.91 -40.91 94.89 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.525 -0.734 . . . . 0.0 109.35 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -58.92 -44.84 91.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.194 -0.941 . . . . 0.0 109.157 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.14 -41.12 97.31 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.494 -0.754 . . . . 0.0 109.045 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -69.58 -68.33 0.42 Allowed 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.405 -0.809 . . . . 0.0 109.432 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -155.42 -80.9 0.08 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 109.273 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 61.78 158.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.67 0.748 . . . . 0.0 110.635 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -77.83 -85.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.584 -0.698 . . . . 0.0 109.723 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -139.71 77.41 1.61 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.572 -0.705 . . . . 0.0 109.16 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -98.16 -95.21 1.98 Allowed Glycine 0 N--CA 1.495 2.61 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -85.26 33.05 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -1.151 . . . . 0.0 108.414 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.624 -0.672 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.9 -45.57 91.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.366 -0.834 . . . . 0.0 109.618 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.54 -41.39 93.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.337 -0.852 . . . . 0.0 109.773 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.021 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 -179.486 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.466 ' SD ' ' N ' ' A' ' 1' ' ' MET . 5.0 mpp? . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.213 0.53 . . . . 0.0 109.786 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -81.29 162.16 23.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.0 110.51 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.9 m -85.02 156.5 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.429 -0.794 . . . . 0.0 109.978 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.61 138.84 51.12 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.72 -0.612 . . . . 0.0 109.594 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -99.6 114.81 28.07 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.393 -0.817 . . . . 0.0 109.531 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -86.72 -75.62 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.432 -0.792 . . . . 0.0 109.66 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -127.2 52.14 1.83 Allowed 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 93.96 -0.41 66.92 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -112.39 140.32 47.22 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.385 -1.068 . . . . 0.0 109.993 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -84.21 145.13 28.51 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.412 HG21 HD11 ' A' ' 11' ' ' ILE . 96.7 mt -120.94 130.2 74.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -127.3 97.75 30.88 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.93 153.79 37.73 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.422 2.082 . . . . 0.0 113.201 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.71 -150.14 8.09 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.52 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 52.7 p-80 -152.67 147.53 26.22 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -1.111 . . . . 0.0 109.428 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.427 ' OE1' ' CZ ' ' A' ' 27' ' ' TYR . 58.4 tt0 -169.05 157.67 8.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.392 -0.818 . . . . 0.0 109.02 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -110.04 145.77 36.47 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.464 0.65 . . . . 0.0 110.002 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.541 HH21 ' CG2' ' A' ' 44' ' ' THR . 35.2 mmt180 -96.32 125.24 40.69 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.658 0.742 . . . . 0.0 109.728 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 38.5 p-10 -70.22 -21.5 63.01 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.715 -0.615 . . . . 0.0 109.959 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -62.33 -42.58 99.49 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.764 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.6 pt -116.7 -6.8 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' ARG . 28.0 mmt180 55.82 57.55 5.11 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.4 0.619 . . . . 0.0 110.034 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -144.09 160.17 41.36 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 0.0 109.788 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -90.23 129.28 36.5 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.628 -0.67 . . . . 0.0 109.375 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 11.8 m -141.93 148.97 51.15 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.447 -0.783 . . . . 0.0 109.544 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -41.48 110.1 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.294 0 C-N-CA 122.307 2.004 . . . . 0.0 111.536 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.427 ' CZ ' ' OE1' ' A' ' 16' ' ' GLN . 56.2 t80 -103.66 116.74 32.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -139.77 144.29 37.35 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.1 mt -109.96 130.45 55.53 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.407 HD13 HG23 ' A' ' 30' ' ' ILE . 96.8 mt -112.71 131.04 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -129.04 132.3 47.46 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -83.89 138.78 33.01 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.427 -0.796 . . . . 0.0 109.619 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.7 t -67.55 133.98 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.407 -0.808 . . . . 0.0 110.36 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.72 -15.83 56.72 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.436 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 23.8 m -153.53 54.69 1.19 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.287 -1.125 . . . . 0.0 109.637 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 29.7 Cg_endo -66.83 -17.64 52.15 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.581 2.187 . . . . 0.0 111.568 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.89 -135.28 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.463 -0.773 . . . . 0.0 110.359 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 52.64 176.33 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.775 0.797 . . . . 0.0 111.049 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 35.3 m -73.18 131.74 83.0 Favored Pre-proline 0 C--N 1.306 -1.294 0 O-C-N 121.486 -0.759 . . . . 0.0 110.003 -178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.28 140.75 45.28 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.141 1.894 . . . . 0.0 112.582 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.403 HG22 HD12 ' A' ' 41' ' ' ILE . 36.6 mm -114.93 103.27 54.85 Favored Pre-proline 0 N--CA 1.494 1.735 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.18 145.1 38.51 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.095 1.863 . . . . 0.0 112.061 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.64 137.49 46.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.548 -0.72 . . . . 0.0 109.457 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.541 ' CG2' HH21 ' A' ' 18' ' ' ARG . 45.8 p -138.09 167.85 20.95 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -130.99 140.39 38.53 Favored Pre-proline 0 N--CA 1.491 1.589 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -43.33 -28.25 1.49 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 122.207 1.938 . . . . 0.0 112.089 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.51 158.79 26.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.317 -0.864 . . . . 0.0 110.158 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -126.8 147.75 49.99 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.637 -0.665 . . . . 0.0 109.389 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.516 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 78.9 m-85 -152.44 114.52 4.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.326 -0.859 . . . . 0.0 109.801 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -71.13 -33.49 70.15 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.529 -0.732 . . . . 0.0 109.207 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -69.74 135.34 49.65 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.528 -0.733 . . . . 0.0 110.332 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.52 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 85.1 tt0 -71.74 -41.05 68.96 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.503 -0.748 . . . . 0.0 109.731 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.21 -45.94 86.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -0.874 . . . . 0.0 109.738 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.516 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.0 t0 -63.99 -38.58 91.6 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.346 -0.846 . . . . 0.0 109.546 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.64 91.83 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.47 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.81 -46.39 82.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.345 -0.847 . . . . 0.0 109.724 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -64.21 -44.38 92.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.325 -0.859 . . . . 0.0 109.621 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.3 t -67.32 -42.03 87.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.393 -0.817 . . . . 0.0 109.761 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.5 p -56.49 -40.75 75.47 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.688 -178.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.413 HD12 HG22 ' A' ' 60' ' ' ILE . 96.6 mt -64.13 -45.66 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.983 -1.073 . . . . 0.0 109.155 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.09 -38.8 86.34 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.6 t -64.95 -50.55 65.98 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.537 -0.727 . . . . 0.0 109.437 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.66 -41.71 43.44 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.62 -0.675 . . . . 0.0 109.634 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.4 ' NZ ' ' CG2' ' A' ' 60' ' ' ILE . 63.2 mttp -62.9 -41.35 99.41 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.293 -0.879 . . . . 0.0 109.337 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.5 mt -64.1 -43.84 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.839 . . . . 0.0 109.805 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -65.54 -45.33 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.0 109.129 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.431 HD13 HG23 ' A' ' 67' ' ' ILE . 97.5 mt -64.62 -44.84 96.71 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.163 -0.961 . . . . 0.0 109.371 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -67.59 -43.78 79.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.333 -0.854 . . . . 0.0 109.719 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.0 p -67.04 -35.59 80.21 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.385 -0.822 . . . . 0.0 109.067 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.38 -43.99 92.81 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.285 -0.884 . . . . 0.0 109.394 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.9 mt -63.75 -40.99 98.06 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.377 -0.827 . . . . 0.0 109.218 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.438 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 57.3 t0 -68.96 -2.18 9.2 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.351 -0.843 . . . . 0.0 109.198 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 67.74 68.0 0.36 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.807 -0.558 . . . . 0.0 110.257 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -122.92 113.72 19.48 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.525 0.679 . . . . 0.0 109.236 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' GLN . 96.8 m-20 51.81 178.09 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.667 0.746 . . . . 0.0 110.965 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.425 ' O ' ' O ' ' A' ' 75' ' ' ASP . 85.9 mt-30 -48.16 -100.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.441 0.639 . . . . 0.0 110.348 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 79' ' ' ALA . . . 61.87 125.12 0.01 OUTLIER Glycine 0 N--CA 1.489 2.223 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.409 ' C ' ' O ' ' A' ' 77' ' ' GLY . 9.1 mt 41.68 22.99 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.52 -0.988 . . . . 0.0 109.586 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' A' ' 77' ' ' GLY . . . -60.21 -47.71 84.81 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.55 -0.719 . . . . 0.0 109.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -65.68 -36.54 83.93 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.339 -0.85 . . . . 0.0 109.451 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.9 mt -84.09 -3.19 57.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.388 -0.82 . . . . 0.0 109.255 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 179.984 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mtp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.294 0.569 . . . . 0.0 109.878 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -77.29 154.44 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.459 -0.775 . . . . 0.0 110.179 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.5 138.72 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.502 -0.749 . . . . 0.0 110.014 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -89.36 159.99 17.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.453 -0.779 . . . . 0.0 109.815 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.91 139.88 47.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.553 -0.717 . . . . 0.0 109.392 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -151.05 119.98 6.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.189 -0.945 . . . . 0.0 109.496 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 54.28 28.04 8.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.648 -0.658 . . . . 0.0 110.199 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 0.21 86.34 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -104.35 139.99 38.53 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.578 -0.954 . . . . 0.0 109.504 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.2 140.74 29.16 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.406 -0.809 . . . . 0.0 109.144 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.42 HD12 HG22 ' A' ' 11' ' ' ILE . 96.7 mt -119.83 130.13 74.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -117.11 121.04 32.96 Favored Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.02 157.68 46.6 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.059 1.839 . . . . 0.0 112.565 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.05 -172.27 44.3 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -150.7 146.06 26.21 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.339 -1.095 . . . . 0.0 109.073 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.51 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 53.8 tt0 -168.47 155.62 7.66 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.276 -0.89 . . . . 0.0 109.002 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -104.91 139.9 38.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.494 -0.754 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.2 mtp180 -90.97 134.43 34.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.559 -0.713 . . . . 0.0 109.566 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 39.0 p-10 -68.29 -21.49 64.78 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.368 -0.833 . . . . 0.0 109.247 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -60.9 -47.68 85.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.554 -0.716 . . . . 0.0 109.867 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 18.6 pt -107.39 -2.5 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.473 -0.767 . . . . 0.0 108.99 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 49.21 46.64 22.77 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.504 -0.747 . . . . 0.0 110.051 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.25 165.9 26.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -0.821 . . . . 0.0 109.598 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -85.04 132.78 34.28 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.541 -0.725 . . . . 0.0 109.766 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.77 156.03 41.26 Favored Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.285 -0.884 . . . . 0.0 108.794 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -43.85 128.94 7.26 Favored 'Trans proline' 0 C--N 1.314 -1.273 0 C-N-CA 122.11 1.873 . . . . 0.0 112.067 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.51 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 66.0 t80 -131.85 120.38 22.5 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.53 151.71 39.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.168 -0.958 . . . . 0.0 108.789 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.2 mt -106.11 129.93 54.1 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.6 mt -110.68 130.44 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.638 -0.664 . . . . 0.0 109.32 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -131.24 126.66 36.06 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -81.49 139.24 35.28 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.339 -0.851 . . . . 0.0 109.741 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 69.9 t -65.62 134.83 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 110.246 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.61 -22.04 37.0 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.7 m -152.46 65.06 5.8 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.154 -1.203 . . . . 0.0 110.158 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.41 -37.01 97.89 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 122.239 1.96 . . . . 0.0 110.918 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -65.01 -125.54 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.074 0.464 . . . . 0.0 110.474 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' THR . 83.6 mmt-85 52.83 28.62 6.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.488 -0.758 . . . . 0.0 109.339 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.426 ' O ' ' O ' ' A' ' 38' ' ' ARG . 27.5 m 60.72 130.59 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.382 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -73.01 152.58 51.63 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 122.339 2.026 . . . . 0.0 112.512 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.6 mm -129.0 89.3 49.1 Favored Pre-proline 0 N--CA 1.499 1.987 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -56.1 145.75 73.87 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.317 2.011 . . . . 0.0 111.547 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -117.1 135.4 53.77 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.556 0.693 . . . . 0.0 109.821 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.0 p -138.03 166.2 24.68 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -133.01 133.89 23.74 Favored Pre-proline 0 N--CA 1.495 1.798 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.82 85.14 1.36 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.957 1.772 . . . . 0.0 112.329 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.444 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 80.7 tt0 -138.62 -16.18 1.17 Allowed 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 47' ' ' GLU . 9.6 m-85 58.39 119.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.131 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.533 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 12.4 m-85 -131.37 133.97 45.82 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.736 0.779 . . . . 0.0 109.419 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -85.06 -24.76 27.99 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.706 -0.621 . . . . 0.0 109.456 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.4 mm? -96.91 126.17 41.87 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 122.079 0.943 . . . . 0.0 109.854 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -67.76 -33.36 74.68 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.53 -47.32 86.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.609 -0.682 . . . . 0.0 110.016 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 14.9 t70 -64.35 -34.39 78.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.513 -0.742 . . . . 0.0 109.342 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.423 ' O ' ' OG ' ' A' ' 59' ' ' SER . . . -59.2 -42.3 90.58 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.564 -0.71 . . . . 0.0 109.538 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -64.13 -49.3 72.72 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.449 -0.782 . . . . 0.0 109.845 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -43.93 95.5 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.488 -0.758 . . . . 0.0 109.418 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.3 t -64.17 -42.27 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.374 -0.829 . . . . 0.0 109.286 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 55' ' ' ALA . 31.2 m -52.39 -42.95 64.44 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.272 -0.892 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.02 -44.77 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.279 -0.888 . . . . 0.0 109.265 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.89 71.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.438 -0.789 . . . . 0.0 109.698 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.93 -43.29 99.16 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.484 -0.76 . . . . 0.0 109.147 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.34 -42.44 41.74 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.403 -0.811 . . . . 0.0 109.285 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -62.58 -43.67 98.23 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.38 -0.825 . . . . 0.0 109.251 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -65.82 -45.19 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.502 -0.749 . . . . 0.0 109.791 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.3 -44.47 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 0.0 109.165 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.03 -45.02 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.134 -0.979 . . . . 0.0 109.112 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -65.13 -44.26 89.23 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.468 -0.77 . . . . 0.0 109.606 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.558 ' O ' ' N ' ' A' ' 73' ' ' ARG . 39.4 m -63.76 -36.64 84.55 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.583 -0.698 . . . . 0.0 109.641 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 13.6 t60 -57.8 -50.62 72.66 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.1 mt -66.5 -42.01 88.03 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.48 -0.762 . . . . 0.0 110.171 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' O ' ' O ' ' A' ' 73' ' ' ARG . 91.7 m-20 -90.6 -67.3 0.86 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.36 -0.838 . . . . 0.0 110.279 -179.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.558 ' N ' ' O ' ' A' ' 69' ' ' SER . 33.9 ttm-85 -58.76 -141.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.653 0.739 . . . . 0.0 110.781 -178.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.405 ' H ' ' CG ' ' A' ' 73' ' ' ARG . 95.6 m-70 -67.14 144.17 56.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.597 -0.689 . . . . 0.0 110.311 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.432 ' N ' ' OD1' ' A' ' 75' ' ' ASP . 35.1 p-10 -92.68 4.71 53.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.491 -0.755 . . . . 0.0 109.131 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.89 -39.99 94.39 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.421 -0.799 . . . . 0.0 109.611 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.451 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . -69.0 142.93 38.78 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.4 mt 55.1 20.44 3.31 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.491 -1.005 . . . . 0.0 109.388 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.92 89.17 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.416 -0.802 . . . . 0.0 109.677 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.01 -37.45 87.25 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.362 -0.836 . . . . 0.0 109.475 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 44.1 mt -82.48 -3.8 56.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.383 -0.823 . . . . 0.0 109.428 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.514 0.674 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -90.05 -72.19 0.58 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.482 -0.761 . . . . 0.0 109.7 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.481 ' CG1' ' OE1' ' A' ' 12' ' ' GLU . 15.3 m -78.16 149.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 0.0 110.435 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.73 153.02 19.18 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.501 -0.749 . . . . 0.0 109.622 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -103.65 128.65 50.93 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.574 -0.704 . . . . 0.0 109.771 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.428 ' OH ' ' OD2' ' A' ' 68' ' ' ASP . 69.8 t80 -143.03 121.89 12.7 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.403 -0.811 . . . . 0.0 109.574 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 54.14 24.73 5.06 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.534 0.683 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.62 4.09 80.16 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.684 ' HH ' ' HZ2' ' A' ' 32' ' ' LYS . 81.5 m-85 -109.53 139.5 44.46 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.532 -0.981 . . . . 0.0 109.975 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -87.28 144.93 26.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.391 -0.818 . . . . 0.0 109.577 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.421 HD12 HG21 ' A' ' 11' ' ' ILE . 96.6 mt -123.47 131.79 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.667 -0.645 . . . . 0.0 109.417 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.481 ' OE1' ' CG1' ' A' ' 3' ' ' VAL . 8.8 tp10 -116.0 117.63 39.19 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.19 155.0 32.96 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.187 1.925 . . . . 0.0 112.845 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.99 -163.76 36.2 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -151.27 146.46 26.06 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.026 -1.279 . . . . 0.0 109.346 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.48 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 49.2 tt0 -166.23 155.31 11.34 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.165 -0.959 . . . . 0.0 109.755 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -107.24 135.51 48.64 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.316 0.579 . . . . 0.0 109.849 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.491 ' O ' ' N ' ' A' ' 22' ' ' ARG . 79.9 mtp85 -96.08 137.97 34.38 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.83 0.824 . . . . 0.0 109.981 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -67.31 -21.98 65.65 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.524 0.678 . . . . 0.0 109.306 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.61 -44.52 96.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.449 -0.782 . . . . 0.0 109.906 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.1 pt -114.68 0.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.491 ' N ' ' O ' ' A' ' 18' ' ' ARG . 84.5 mtt85 43.56 41.08 3.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.546 -0.721 . . . . 0.0 110.235 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -136.69 159.83 40.65 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.414 -0.804 . . . . 0.0 109.793 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -87.18 119.23 27.2 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.453 0.644 . . . . 0.0 109.735 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.6 m -130.93 152.83 81.32 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -41.74 114.11 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.722 1.615 . . . . 0.0 111.282 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.48 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 64.7 t80 -111.47 121.32 44.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.595 -0.691 . . . . 0.0 109.644 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.56 154.98 44.15 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.326 -0.859 . . . . 0.0 108.985 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.0 mt -112.31 132.46 54.95 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -113.09 131.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.419 ' NH2' ' OD1' ' A' ' 37' ' ' ASP . 58.4 ttm-85 -132.67 136.69 46.61 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.605 -0.685 . . . . 0.0 109.689 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.684 ' HZ2' ' HH ' ' A' ' 9' ' ' TYR . 64.0 tttp -80.19 134.29 36.12 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.689 0.757 . . . . 0.0 109.735 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t -83.27 130.37 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.479 -0.763 . . . . 0.0 110.501 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 126.75 -48.71 0.95 Allowed Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.445 ' O ' ' O ' ' A' ' 36' ' ' PRO . 33.6 m -92.34 151.49 41.51 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.189 -1.183 . . . . 0.0 110.135 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' VAL . 53.0 Cg_exo -48.96 -168.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.349 2.033 . . . . 0.0 113.076 179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.419 ' OD1' ' NH2' ' A' ' 31' ' ' ARG . 67.5 t0 -82.44 93.43 7.23 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.487 -0.758 . . . . 0.0 109.277 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.456 ' CZ ' ' O ' ' A' ' 80' ' ' ASP . 84.8 mtp180 -90.68 161.51 15.33 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.473 -0.767 . . . . 0.0 110.057 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.2 m -45.69 108.76 0.84 Allowed Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.471 -0.768 . . . . 0.0 109.821 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.95 154.13 37.89 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.169 1.913 . . . . 0.0 112.682 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.3 mp -121.99 130.12 24.86 Favored Pre-proline 0 N--CA 1.494 1.738 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.4 148.93 55.68 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.125 1.883 . . . . 0.0 112.488 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.98 129.99 54.55 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.3 p -140.05 167.41 22.2 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 47' ' ' GLU . 9.2 t80 -135.58 136.53 24.02 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.637 -0.664 . . . . 0.0 109.626 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -45.38 81.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.373 2.049 . . . . 0.0 112.183 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 45' ' ' TYR . 6.3 pt-20 178.08 133.8 0.07 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -116.61 163.17 16.5 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.725 0.774 . . . . 0.0 109.491 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.512 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 90.0 m-85 -145.15 -35.24 0.32 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.583 -0.698 . . . . 0.0 109.257 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 49' ' ' TYR . 5.4 t0 79.84 -18.12 0.53 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 51' ' ' LEU . 3.6 mm? -98.98 126.36 44.66 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 122.185 0.993 . . . . 0.0 110.153 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -32.25 73.7 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.88 -51.79 66.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.307 -0.871 . . . . 0.0 109.914 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.512 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 39.2 t0 -72.14 -36.76 69.45 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.711 0.767 . . . . 0.0 109.486 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.08 -47.37 85.49 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.424 -0.798 . . . . 0.0 109.922 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.42 -45.1 89.01 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -63.87 -45.09 91.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.127 -0.983 . . . . 0.0 109.924 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -67.56 -42.34 86.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.333 -0.854 . . . . 0.0 109.093 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 99.9 p -55.76 -40.61 72.84 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.446 -0.784 . . . . 0.0 109.668 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.1 mt -64.94 -45.01 96.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.95 -1.094 . . . . 0.0 109.646 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.44 -42.26 79.11 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.048 -1.033 . . . . 0.0 109.549 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 90.6 m -68.55 -39.16 81.19 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.459 -0.776 . . . . 0.0 109.476 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -46.79 71.34 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.238 -0.914 . . . . 0.0 109.064 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -63.17 -41.73 99.28 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.418 HD11 HG22 ' A' ' 65' ' ' ILE . 97.2 mt -65.39 -42.79 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.823 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.2 mm -63.69 -43.24 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.04 -1.037 . . . . 0.0 109.191 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 91.8 mt -62.88 -47.71 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 120.993 -1.067 . . . . 0.0 109.377 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.428 ' OD2' ' OH ' ' A' ' 6' ' ' TYR . 97.9 m-20 -66.14 -44.12 85.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.381 -0.824 . . . . 0.0 109.698 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.55 ' O ' ' N ' ' A' ' 73' ' ' ARG . 11.8 t -63.23 -41.43 99.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.487 -0.758 . . . . 0.0 109.315 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.578 ' HD1' ' H ' ' A' ' 75' ' ' ASP . 73.5 t60 -58.77 -39.08 79.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.423 -0.798 . . . . 0.0 109.634 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.481 ' O ' ' NE2' ' A' ' 74' ' ' HIS . 85.5 mt -63.4 -42.54 98.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.223 -0.923 . . . . 0.0 110.112 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -94.24 -13.8 26.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.234 -0.917 . . . . 0.0 110.192 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.55 ' N ' ' O ' ' A' ' 69' ' ' SER . 65.2 ttt180 -106.98 -41.75 5.1 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.311 -0.868 . . . . 0.0 109.6 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.523 ' N ' ' O ' ' A' ' 70' ' ' HIS . 89.3 m-70 56.5 75.7 0.34 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.964 0.888 . . . . 0.0 109.324 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.578 ' H ' ' HD1' ' A' ' 70' ' ' HIS . 42.0 p-10 -93.6 16.04 14.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.676 -0.64 . . . . 0.0 109.398 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 75' ' ' ASP . 2.5 tm0? 82.76 -24.2 0.18 Allowed 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.543 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . -64.36 154.0 48.26 Favored Glycine 0 N--CA 1.493 2.444 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.089 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.8 mt 63.04 -9.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 122.004 -0.704 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.543 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.9 -34.17 77.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.003 -1.06 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.456 ' O ' ' CZ ' ' A' ' 38' ' ' ARG . 99.2 m-20 -65.01 -13.95 59.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.428 -0.795 . . . . 0.0 109.474 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.99 -5.17 59.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.22 -0.925 . . . . 0.0 109.003 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.79 -1.561 . . . . 0.0 109.321 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mtm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -86.44 -4.13 59.12 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.567 -0.708 . . . . 0.0 109.134 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.54 149.8 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.356 -0.84 . . . . 0.0 110.006 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.22 135.44 54.68 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.637 -0.664 . . . . 0.0 109.28 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m170 -84.6 146.7 27.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.429 -0.794 . . . . 0.0 110.373 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -154.6 119.16 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.527 -0.733 . . . . 0.0 109.117 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? 54.69 26.81 7.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.627 -0.67 . . . . 0.0 109.921 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.63 2.8 81.59 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -107.45 140.08 40.96 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.553 -0.969 . . . . 0.0 109.709 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -89.92 142.08 28.04 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.5 -0.75 . . . . 0.0 109.476 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -123.97 132.75 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -119.91 87.95 39.35 Favored Pre-proline 0 N--CA 1.496 1.835 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.66 149.4 68.12 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 122.734 2.289 . . . . 0.0 112.463 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.24 139.68 4.69 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 15' ' ' HIS . 45.2 p-80 -95.1 123.23 38.48 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.521 -0.988 . . . . 0.0 109.96 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -149.91 153.16 36.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.156 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -104.36 138.9 40.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.636 -0.665 . . . . 0.0 109.468 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -103.02 141.9 35.02 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.489 0.661 . . . . 0.0 110.349 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -68.77 -8.81 46.57 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.292 -0.88 . . . . 0.0 109.378 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -68.06 -52.86 30.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.438 ' CD1' ' H ' ' A' ' 23' ' ' LYS . 1.2 pp -108.26 7.27 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 40.89 37.92 0.59 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.823 -0.548 . . . . 0.0 110.123 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.438 ' H ' ' CD1' ' A' ' 21' ' ' ILE . 34.7 mmtt -141.16 176.79 8.55 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.352 -0.843 . . . . 0.0 109.706 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -86.82 127.43 35.01 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.303 0.573 . . . . 0.0 109.633 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -138.61 154.75 73.52 Favored Pre-proline 0 N--CA 1.493 1.681 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -58.52 110.29 0.63 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.239 1.959 . . . . 0.0 111.496 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -112.62 118.4 34.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.514 -0.741 . . . . 0.0 109.37 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.01 153.6 42.39 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -102.82 133.88 47.16 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.634 -0.666 . . . . 0.0 109.554 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.415 HG21 HD13 ' A' ' 30' ' ' ILE . 97.3 mt -110.0 128.07 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -136.41 138.86 41.98 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.628 -0.67 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -93.61 134.69 35.65 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.474 -0.766 . . . . 0.0 109.556 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.463 ' C ' ' H ' ' A' ' 35' ' ' VAL . 91.2 t -63.23 -43.79 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.589 -0.694 . . . . 0.0 110.224 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.55 3.3 1.96 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.463 ' H ' ' C ' ' A' ' 33' ' ' VAL . 4.8 t -146.54 71.2 12.82 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.066 -1.255 . . . . 0.0 109.195 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.437 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 31.7 Cg_exo -56.24 -43.86 52.04 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.18 1.92 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -95.82 112.16 23.96 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.423 0.63 . . . . 0.0 109.719 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.488 ' HE ' ' C ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -168.63 -165.24 0.56 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.1 m -112.0 97.6 38.95 Favored Pre-proline 0 N--CA 1.496 1.828 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.54 143.49 55.87 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 122.35 2.034 . . . . 0.0 112.127 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.3 mp -124.03 125.04 25.89 Favored Pre-proline 0 N--CA 1.491 1.601 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -71.63 143.96 43.37 Favored 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 121.842 1.694 . . . . 0.0 112.278 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 t -107.2 137.0 46.09 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -130.52 165.07 23.48 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.536 ' O ' ' N ' ' A' ' 47' ' ' GLU . 24.2 t80 -139.1 110.74 7.81 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -45.53 83.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.966 1.777 . . . . 0.0 112.33 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 45' ' ' TYR . 8.4 tm-20 -171.91 132.24 0.69 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.252 -0.905 . . . . 0.0 109.085 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -98.9 125.66 44.37 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 108.991 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.549 ' C ' ' H ' ' A' ' 51' ' ' LEU . 84.8 m-85 -109.03 -32.37 7.27 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.6 t0 62.97 -3.8 0.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.549 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.4 mt -115.47 131.54 56.9 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.595 -0.691 . . . . 0.0 109.737 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -68.47 -39.43 81.39 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.651 -0.656 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -50.34 74.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.74 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -64.34 -40.2 95.41 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.46 -0.775 . . . . 0.0 109.427 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.77 92.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.476 -0.765 . . . . 0.0 109.95 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -66.98 -49.37 65.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.403 -0.81 . . . . 0.0 110.1 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -64.98 -44.2 90.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.334 -0.854 . . . . 0.0 109.659 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.7 t -66.7 -42.37 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.56 -0.712 . . . . 0.0 109.564 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 p -54.72 -40.41 69.22 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.245 -0.909 . . . . 0.0 109.549 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -65.22 -45.02 95.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.204 -0.935 . . . . 0.0 109.368 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.34 51.83 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.404 -0.81 . . . . 0.0 109.733 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.1 m -60.92 -38.9 87.36 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.557 -0.715 . . . . 0.0 109.28 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.86 -41.12 70.42 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.46 -0.775 . . . . 0.0 109.188 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.18 -38.71 92.24 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.338 -0.852 . . . . 0.0 109.123 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.56 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.453 -0.779 . . . . 0.0 109.665 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.35 -44.35 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.339 -0.851 . . . . 0.0 108.746 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.68 -44.36 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.313 -0.867 . . . . 0.0 109.272 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.49 -41.51 96.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.563 -0.711 . . . . 0.0 109.573 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.514 ' O ' ' N ' ' A' ' 73' ' ' ARG . 50.8 m -61.58 -41.99 98.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.529 -0.732 . . . . 0.0 110.012 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -61.21 -47.16 87.4 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.125 -0.984 . . . . 0.0 109.467 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.87 -42.2 95.03 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.481 -0.762 . . . . 0.0 109.321 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -82.39 -70.08 0.57 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.553 -0.717 . . . . 0.0 109.653 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' SER . 85.8 mtp180 -73.88 147.63 43.05 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.533 -0.73 . . . . 0.0 110.098 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -78.4 62.24 2.99 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 0.0 109.048 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.532 ' C ' ' H ' ' A' ' 77' ' ' GLY . 62.2 t0 -87.65 110.82 20.68 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.482 -0.761 . . . . 0.0 109.699 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -68.92 11.57 0.19 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.525 -0.734 . . . . 0.0 109.533 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.532 ' H ' ' C ' ' A' ' 75' ' ' ASP . . . -60.73 -40.97 98.82 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.689 -1.365 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.3 mt -112.16 32.68 5.35 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.959 . . . . 0.0 109.138 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.71 88.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.553 -0.717 . . . . 0.0 109.554 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.69 -34.77 79.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.595 -0.691 . . . . 0.0 109.899 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.2 mt -80.18 -2.93 46.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.617 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 CA-C-O 117.866 -1.519 . . . . 0.0 109.428 179.747 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.41 ' O ' ' O ' ' A' ' 2' ' ' ASN . 37.7 ttm . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.41 ' O ' ' O ' ' A' ' 1' ' ' MET . 99.5 m-20 42.96 -168.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.712 0.768 . . . . 0.0 111.043 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.4 m -75.04 141.35 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.688 0.756 . . . . 0.0 110.264 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.04 131.3 43.98 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.76 0.79 . . . . 0.0 109.706 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -83.86 149.26 26.49 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.671 0.748 . . . . 0.0 110.184 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -153.43 113.65 3.96 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.763 0.792 . . . . 0.0 109.401 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.8 mtp180 49.41 29.52 2.88 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.631 0.729 . . . . 0.0 110.104 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 96.23 -19.61 53.77 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -83.71 142.14 30.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -1.029 . . . . 0.0 110.625 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.49 145.81 24.53 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.624 -0.673 . . . . 0.0 109.604 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 94.6 mt -125.21 129.72 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-O 121.483 0.659 . . . . 0.0 109.483 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -123.68 93.23 47.73 Favored Pre-proline 0 N--CA 1.495 1.781 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.49 157.46 32.58 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.759 2.306 . . . . 0.0 113.209 -178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.3 -133.71 1.75 Allowed Glycine 0 N--CA 1.488 2.153 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.545 ' ND1' ' OE2' ' A' ' 52' ' ' GLU . 20.2 p-80 -160.05 135.67 8.33 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.435 -1.038 . . . . 0.0 109.899 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.525 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 54.2 tt0 -166.62 154.4 9.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.639 -0.663 . . . . 0.0 109.301 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.9 p90 -112.79 144.62 42.01 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 121.711 0.767 . . . . 0.0 109.942 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -99.15 137.67 37.35 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.622 0.725 . . . . 0.0 109.969 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -68.21 -20.31 64.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.774 -0.579 . . . . 0.0 109.886 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -65.37 -42.43 92.75 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.314 -0.866 . . . . 0.0 109.917 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 11.4 pt -109.91 -6.16 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.47 -0.769 . . . . 0.0 109.016 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 48.25 44.13 19.45 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.807 0.813 . . . . 0.0 109.964 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -145.56 163.21 35.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.509 -0.745 . . . . 0.0 110.202 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -86.22 132.12 34.08 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.843 0.83 . . . . 0.0 110.229 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.8 m -142.49 148.72 48.22 Favored Pre-proline 0 N--CA 1.491 1.592 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -39.94 109.99 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.395 2.063 . . . . 0.0 111.416 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.525 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 56.1 t80 -104.08 120.29 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.603 0.716 . . . . 0.0 109.961 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -142.13 145.8 34.65 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.496 -0.753 . . . . 0.0 109.097 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 65.7 mt -110.14 126.57 54.2 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.401 HD12 HG23 ' A' ' 30' ' ' ILE . 91.0 mt -104.05 127.45 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.516 0.674 . . . . 0.0 109.532 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -130.1 137.98 50.45 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.59 0.71 . . . . 0.0 109.464 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -95.2 130.53 41.9 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 109.28 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.74 131.41 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.3 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 122.98 -38.76 2.42 Favored Glycine 0 N--CA 1.497 2.736 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.6 m -152.86 58.51 2.46 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.321 -1.105 . . . . 0.0 110.003 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -74.5 -170.88 0.8 Allowed 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.356 2.037 . . . . 0.0 111.965 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 56.34 36.45 27.53 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.606 0.717 . . . . 0.0 109.298 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.413 ' O ' ' C ' ' A' ' 39' ' ' THR . 23.5 mmt180 -117.62 90.02 3.24 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.507 0.67 . . . . 0.0 109.684 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.413 ' C ' ' O ' ' A' ' 38' ' ' ARG . 7.8 m 42.31 81.11 0.26 Allowed Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.71 144.14 98.2 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.348 2.032 . . . . 0.0 112.393 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.14 89.97 51.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -52.87 141.6 55.04 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 C-N-CA 122.517 2.145 . . . . 0.0 112.227 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.1 t -108.65 134.61 51.15 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.812 0.815 . . . . 0.0 110.003 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 56.9 p -139.66 166.85 23.5 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.608 ' O ' ' N ' ' A' ' 47' ' ' GLU . 8.8 t80 -136.05 133.42 19.7 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -42.78 76.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.898 2.399 . . . . 0.0 112.382 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.608 ' N ' ' O ' ' A' ' 45' ' ' TYR . 39.8 mt-10 -155.06 145.05 21.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.564 -0.71 . . . . 0.0 109.131 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -115.39 110.15 18.93 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.696 -0.628 . . . . 0.0 109.345 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -124.28 129.79 51.37 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.557 0.694 . . . . 0.0 109.669 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -92.99 -24.84 18.23 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -78.68 143.02 36.67 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.826 0.822 . . . . 0.0 110.323 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.545 ' OE2' ' ND1' ' A' ' 15' ' ' HIS . 46.2 tp10 -71.89 -38.49 69.97 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.578 0.704 . . . . 0.0 109.758 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.97 87.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.79 . . . . 0.0 109.862 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -63.68 -43.43 96.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 109.739 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.12 88.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.512 -0.743 . . . . 0.0 109.899 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -69.37 -45.08 70.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.487 -0.758 . . . . 0.0 110.08 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -64.07 -45.4 88.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.335 -0.853 . . . . 0.0 110.037 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.7 t -67.53 -41.79 86.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.558 0.694 . . . . 0.0 109.742 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.1 p -57.18 -42.43 81.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.37 -0.831 . . . . 0.0 110.045 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.417 HD13 HG23 ' A' ' 60' ' ' ILE . 96.6 mt -64.87 -45.07 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.117 -0.989 . . . . 0.0 109.645 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.89 -49.45 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.222 -0.924 . . . . 0.0 109.805 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.1 m -61.82 -35.19 77.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.473 -0.767 . . . . 0.0 109.485 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.55 -41.03 89.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.395 -0.815 . . . . 0.0 109.523 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.26 -45.74 86.78 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.296 -0.877 . . . . 0.0 109.805 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 3.0 mp -67.47 -42.08 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.369 -0.832 . . . . 0.0 109.818 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -62.22 -43.74 98.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 121.384 -0.822 . . . . 0.0 109.789 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.95 -44.71 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.228 -0.92 . . . . 0.0 109.319 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.457 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 73.9 m-20 -64.24 -44.06 92.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.378 -0.826 . . . . 0.0 109.264 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.414 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 77.2 p -64.47 -47.6 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 0.0 109.768 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.684 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 53.8 t60 -47.06 -44.02 20.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.293 -0.879 . . . . 0.0 109.441 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.34 -40.72 98.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.38 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -135.57 72.57 1.45 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.453 -0.779 . . . . 0.0 109.266 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.434 ' CG ' ' H ' ' A' ' 74' ' ' HIS . 11.0 tpp85 -174.06 -127.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.511 0.672 . . . . 0.0 109.973 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.434 ' H ' ' CG ' ' A' ' 73' ' ' ARG . 59.0 t-80 -51.47 130.91 28.56 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.92 0.867 . . . . 0.0 110.347 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 49.6 p-10 -65.05 136.07 56.32 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 121.741 0.782 . . . . 0.0 110.707 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 57.58 156.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.802 0.81 . . . . 0.0 110.784 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.12 -74.05 0.18 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.684 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 59.5 mt -102.59 14.65 31.42 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.326 -1.102 . . . . 0.0 109.201 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.12 -26.08 68.38 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.505 -0.747 . . . . 0.0 109.9 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -68.08 -17.16 64.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.325 -0.859 . . . . 0.0 109.676 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.9 mt -92.93 -2.13 56.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.186 -0.947 . . . . 0.0 109.262 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.807 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 tpp . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -86.4 114.88 23.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.444 -0.785 . . . . 0.0 109.975 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.8 m -81.14 151.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 CA-C-O 121.666 0.746 . . . . 0.0 110.441 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.8 139.89 48.05 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -101.63 122.48 43.95 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.737 0.779 . . . . 0.0 109.876 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -101.69 -101.12 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.403 0.621 . . . . 0.0 109.509 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -90.96 51.46 1.96 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.361 -0.837 . . . . 0.0 109.546 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.7 90.51 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.06 138.19 44.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.506 -0.997 . . . . 0.0 109.896 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -80.45 141.07 35.6 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.629 -0.669 . . . . 0.0 109.379 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.433 HG23 HD13 ' A' ' 11' ' ' ILE . 97.6 mt -119.47 129.0 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.38 0.61 . . . . 0.0 109.448 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -132.22 97.97 17.58 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -76.94 154.11 33.3 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.622 2.215 . . . . 0.0 112.868 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.2 102.89 0.17 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -42.05 129.68 3.6 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.69 -0.888 . . . . 0.0 110.713 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.448 ' CD ' ' H ' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -156.93 158.1 36.02 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.614 0.721 . . . . 0.0 109.427 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.448 ' H ' ' CD ' ' A' ' 16' ' ' GLN . 48.3 p90 -113.5 145.8 40.63 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.817 0.817 . . . . 0.0 110.038 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.625 HH21 ' CG2' ' A' ' 44' ' ' THR . 32.3 mmt180 -92.51 130.75 38.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.767 0.794 . . . . 0.0 109.612 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 45.1 p-10 -71.72 -23.78 61.68 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.73 -0.606 . . . . 0.0 109.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 90.7 m-20 -61.79 -44.64 96.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.6 pt -109.39 -7.63 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.378 -0.826 . . . . 0.0 109.102 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' ARG . 80.5 mtp85 54.8 53.43 10.51 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.591 0.71 . . . . 0.0 110.197 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -146.53 162.36 38.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.383 -0.823 . . . . 0.0 110.377 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -88.14 128.53 35.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.617 -0.677 . . . . 0.0 109.664 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.8 m -147.14 148.24 31.45 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.484 -0.76 . . . . 0.0 109.391 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -42.47 109.23 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 122.282 1.988 . . . . 0.0 111.508 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -112.39 120.96 43.47 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.347 -0.846 . . . . 0.0 110.163 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.72 145.67 42.79 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 83.1 mt -101.78 130.26 48.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.537 -0.727 . . . . 0.0 109.301 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.432 HD11 HG22 ' A' ' 30' ' ' ILE . 93.1 mt -109.64 124.4 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 CA-C-O 121.579 0.704 . . . . 0.0 109.901 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -130.61 140.44 50.42 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.644 0.735 . . . . 0.0 109.572 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -86.9 137.25 32.54 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-O 121.606 0.717 . . . . 0.0 109.643 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.17 132.47 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 CA-C-O 121.806 0.812 . . . . 0.0 110.583 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.39 -20.65 43.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.441 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 27.9 m -152.66 53.22 1.0 Allowed Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.364 -1.08 . . . . 0.0 110.094 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 64.6 Cg_endo -74.1 -11.78 23.35 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.736 2.29 . . . . 0.0 110.815 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -75.02 -4.91 41.12 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.61 -0.681 . . . . 0.0 109.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.447 ' O ' ' C ' ' A' ' 39' ' ' THR . 37.7 mmt180 -81.2 144.14 31.83 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.385 -0.822 . . . . 0.0 110.241 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 38' ' ' ARG . 24.9 m -35.04 98.42 0.15 Allowed Pre-proline 0 N--CA 1.495 1.797 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.203 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.08 146.91 46.14 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.427 2.085 . . . . 0.0 112.721 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -109.75 111.02 59.19 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.55 157.42 44.67 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.546 2.164 . . . . 0.0 112.461 -179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -121.97 135.55 54.86 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.577 0.703 . . . . 0.0 109.71 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.625 ' CG2' HH21 ' A' ' 18' ' ' ARG . 43.7 p -131.03 166.84 20.14 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' A' ' 47' ' ' GLU . 1.1 t80 -135.58 133.19 20.08 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.509 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 77.1 Cg_exo -45.23 -12.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.313 2.009 . . . . 0.0 111.468 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' TYR . 97.0 mt-10 -84.0 160.27 21.05 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.57 -0.706 . . . . 0.0 109.937 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -131.28 148.65 52.71 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.598 0.713 . . . . 0.0 109.362 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.527 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 62.4 m-85 -149.62 118.91 6.82 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.477 -0.765 . . . . 0.0 109.241 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -74.12 -13.39 60.82 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -94.67 128.54 41.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 109.877 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.524 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -67.79 -36.15 79.93 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.483 0.659 . . . . 0.0 110.19 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.36 -43.87 92.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.365 -0.834 . . . . 0.0 109.753 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 51.3 t0 -65.94 -38.85 89.7 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.417 -0.802 . . . . 0.0 109.544 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.95 -37.07 86.07 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.531 -0.731 . . . . 0.0 109.595 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -64.48 -50.24 68.23 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.392 -0.818 . . . . 0.0 109.807 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -67.27 -44.06 80.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.833 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.4 t -67.4 -42.98 87.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.457 -0.777 . . . . 0.0 110.238 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 77.8 p -59.6 -41.08 89.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 110.206 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -65.83 -44.44 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 120.987 -1.07 . . . . 0.0 109.473 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -45.2 76.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.437 -0.789 . . . . 0.0 109.898 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.57 -46.38 72.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.361 -0.837 . . . . 0.0 109.985 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -48.2 -46.15 34.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.448 -0.783 . . . . 0.0 109.799 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.34 -41.82 98.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.361 -0.837 . . . . 0.0 109.418 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 91.0 mt -64.47 -44.03 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.505 -0.747 . . . . 0.0 109.691 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.15 -43.99 99.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.01 -44.03 99.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 O-C-N 121.583 -0.698 . . . . 0.0 109.2 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.23 -42.62 93.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.668 0.747 . . . . 0.0 109.301 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' ARG . 38.7 t -69.92 -34.12 73.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.554 -0.716 . . . . 0.0 109.789 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.472 ' CD2' ' C ' ' A' ' 70' ' ' HIS . 0.0 OUTLIER -57.75 -47.74 81.62 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.282 -0.886 . . . . 0.0 108.78 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.5 mt -64.25 -40.32 95.77 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -82.46 -78.86 0.19 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.508 0.67 . . . . 0.0 109.711 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 69' ' ' SER . 84.8 mtt85 -80.54 147.18 30.93 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.682 0.753 . . . . 0.0 110.669 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.411 ' O ' ' O ' ' A' ' 73' ' ' ARG . 62.5 m170 58.22 121.89 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.803 0.811 . . . . 0.0 110.417 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -93.4 -18.45 22.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 0.0 109.175 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.41 ' O ' ' C ' ' A' ' 77' ' ' GLY . 99.0 mm-40 -80.95 -6.33 58.58 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.317 -0.865 . . . . 0.0 109.576 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.41 ' C ' ' O ' ' A' ' 76' ' ' GLN . . . -39.31 -82.66 0.02 OUTLIER Glycine 0 N--CA 1.5 2.916 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.436 ' H ' ' CD2' ' A' ' 70' ' ' HIS . 46.5 mt -109.84 32.96 4.67 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.514 -0.992 . . . . 0.0 108.854 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.42 76.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.519 -0.738 . . . . 0.0 109.315 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.92 -37.44 87.4 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.424 -0.797 . . . . 0.0 109.261 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.5 mt -86.8 -5.69 59.04 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.096 -1.002 . . . . 0.0 108.805 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.92 -1.489 . . . . 0.0 109.413 179.507 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.4 tpp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -84.9 143.45 29.01 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 110.156 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m -87.94 154.91 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-O 121.813 0.816 . . . . 0.0 110.631 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.29 146.77 31.1 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -102.83 136.9 41.8 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.741 0.781 . . . . 0.0 110.217 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -149.38 120.69 7.85 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.77 0.795 . . . . 0.0 109.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 48.98 30.84 2.96 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.741 0.781 . . . . 0.0 110.452 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.32 -20.26 41.85 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -81.02 144.16 31.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.341 -1.093 . . . . 0.0 110.299 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -104.32 139.07 39.83 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -115.01 137.57 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.648 0.737 . . . . 0.0 110.122 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -118.65 90.0 38.74 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.62 145.85 46.33 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.947 2.431 . . . . 0.0 112.907 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.28 -171.95 40.53 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -149.15 141.02 23.68 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.999 . . . . 0.0 109.773 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -170.02 155.74 5.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.587 -0.696 . . . . 0.0 109.514 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -105.3 137.9 42.36 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.861 0.838 . . . . 0.0 110.146 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.4 141.16 36.44 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.389 0.614 . . . . 0.0 109.585 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 37.4 p-10 -68.44 -8.28 39.3 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.756 0.789 . . . . 0.0 109.349 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -64.27 -42.44 96.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.392 -0.818 . . . . 0.0 109.205 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.412 ' O ' ' C ' ' A' ' 22' ' ' ARG . 1.1 pp -122.58 12.71 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ILE . 89.0 mtm180 38.48 34.62 0.08 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.632 0.729 . . . . 0.0 110.102 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -138.35 169.12 18.35 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.054 0.931 . . . . 0.0 110.359 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -85.3 135.37 33.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.635 0.731 . . . . 0.0 109.891 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -147.37 147.64 28.94 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.377 -0.827 . . . . 0.0 109.493 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -38.19 109.21 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 C-N-CA 122.685 2.257 . . . . 0.0 111.65 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -109.05 112.0 23.94 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.16 145.7 37.84 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.529 -0.732 . . . . 0.0 109.424 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.92 124.87 49.25 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.407 HD13 HG21 ' A' ' 30' ' ' ILE . 97.7 mt -112.36 133.26 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-O 121.461 0.648 . . . . 0.0 109.797 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.99 138.33 43.89 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.613 0.721 . . . . 0.0 109.355 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -83.28 134.76 34.92 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.707 0.765 . . . . 0.0 110.267 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.1 t -70.61 134.25 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-O 121.732 0.777 . . . . 0.0 110.5 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.86 -14.26 31.84 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 108.707 -1.757 . . . . 0.0 108.707 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.442 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 15.6 m -153.28 53.53 1.01 Allowed Pre-proline 0 N--CA 1.49 1.546 0 O-C-N 121.237 -1.155 . . . . 0.0 109.636 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 42.8 Cg_endo -72.04 -10.74 26.47 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.643 2.228 . . . . 0.0 111.106 179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -74.38 -4.42 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.486 -0.758 . . . . 0.0 109.051 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.515 ' NH1' ' O ' ' A' ' 81' ' ' LEU . 91.8 mtt180 -86.99 137.94 31.93 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.91 0.862 . . . . 0.0 110.607 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -52.36 121.77 22.28 Favored Pre-proline 0 N--CA 1.487 1.407 0 O-C-N 121.886 -0.509 . . . . 0.0 110.435 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.76 151.96 52.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.71 2.274 . . . . 0.0 112.984 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.2 mp -118.38 130.89 24.49 Favored Pre-proline 0 N--CA 1.495 1.78 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.04 145.98 45.88 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.523 2.148 . . . . 0.0 112.246 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.9 t -116.52 137.13 52.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.703 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -138.22 167.65 21.38 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.309 0.576 . . . . 0.0 109.666 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -126.83 145.21 52.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.48 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 81.6 Cg_exo -43.2 -26.31 0.82 Allowed 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.24 1.96 . . . . 0.0 111.574 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -69.73 160.4 31.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.744 . . . . 0.0 110.515 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 46' ' ' PRO . 73.2 m-85 -128.37 146.55 50.74 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.544 0.688 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.518 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 71.8 m-85 -148.55 121.91 9.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.469 -0.769 . . . . 0.0 109.877 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -82.59 -20.18 36.98 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -81.77 136.31 35.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.34 -0.85 . . . . 0.0 109.881 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.86 -40.58 72.23 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.61 0.719 . . . . 0.0 109.778 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.96 99.23 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.411 -0.806 . . . . 0.0 109.807 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.518 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 54.1 t0 -65.26 -39.63 92.9 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.41 -0.806 . . . . 0.0 109.906 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.1 95.0 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.261 -0.899 . . . . 0.0 109.839 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.94 -46.02 76.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.31 -0.869 . . . . 0.0 109.858 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.57 -44.3 91.12 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.236 -0.915 . . . . 0.0 109.95 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.3 t -66.83 -41.71 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.496 -0.752 . . . . 0.0 109.906 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.2 p -56.95 -41.28 78.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.325 -0.86 . . . . 0.0 109.989 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.12 -45.76 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.023 -1.048 . . . . 0.0 109.66 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.52 -53.72 26.17 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.271 -0.893 . . . . 0.0 109.929 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.7 m -62.95 -35.66 80.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.387 -0.821 . . . . 0.0 109.809 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.65 -43.26 76.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.165 -0.96 . . . . 0.0 108.818 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -63.16 -39.66 95.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 0.0 108.747 179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -64.92 -43.62 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.308 -0.87 . . . . 0.0 108.736 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.0 mm -64.29 -43.93 97.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.725 0.774 . . . . 0.0 109.555 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -64.21 -44.24 97.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 O-C-N 121.464 -0.772 . . . . 0.0 109.4 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -64.88 -45.22 86.9 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.81 0.814 . . . . 0.0 109.554 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -62.78 -38.95 92.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.429 -0.794 . . . . 0.0 109.868 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.499 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 79.4 t60 -60.82 -40.95 94.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.21 -0.931 . . . . 0.0 109.852 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.09 -41.73 99.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.373 -0.829 . . . . 0.0 109.823 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -79.69 -63.73 1.35 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.16 -0.962 . . . . 0.0 108.991 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -171.17 132.61 0.82 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 109.493 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.419 ' CG ' ' N ' ' A' ' 75' ' ' ASP . 76.6 t60 -161.56 168.22 23.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.321 -0.862 . . . . 0.0 109.536 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.533 ' CG ' ' H ' ' A' ' 76' ' ' GLN . 43.9 t0 -84.24 -176.64 6.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.565 -0.71 . . . . 0.0 110.437 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.533 ' H ' ' CG ' ' A' ' 75' ' ' ASP . 17.0 tm0? -39.15 92.74 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.723 0.773 . . . . 0.0 110.495 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.528 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . -164.77 122.42 1.08 Allowed Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.3 mt 59.65 1.16 0.27 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.724 -0.868 . . . . 0.0 109.58 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.528 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.17 -34.46 78.13 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.483 -0.761 . . . . 0.0 109.431 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.98 -41.05 97.6 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.251 -0.906 . . . . 0.0 109.794 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.515 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 57.0 mt -63.53 -40.32 96.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.301 -0.875 . . . . 0.0 109.477 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 -179.899 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.7 mmm . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.776 0.798 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 43.02 -100.12 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.658 0.742 . . . . 0.0 110.314 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.1 m -91.64 152.93 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.201 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.18 137.42 51.48 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.696 0.76 . . . . 0.0 109.792 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -82.25 151.2 26.92 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.614 0.721 . . . . 0.0 110.086 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -154.51 111.84 3.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.445 ' NH2' ' CD1' ' A' ' 71' ' ' LEU . 84.1 mtp180 49.75 35.59 9.33 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.69 0.757 . . . . 0.0 110.534 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.32 -5.76 83.87 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -105.41 137.34 43.37 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.239 -1.154 . . . . 0.0 110.252 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -89.22 144.85 25.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.746 -0.596 . . . . 0.0 109.461 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.74 130.04 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-O 121.424 0.63 . . . . 0.0 109.391 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.433 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 49.6 tt0 -121.26 117.95 30.27 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.98 154.22 42.44 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.609 2.206 . . . . 0.0 113.023 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.43 -167.3 39.2 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -151.07 156.01 40.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.511 -0.993 . . . . 0.0 109.509 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 57.4 tt0 -152.98 154.1 34.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.544 -0.723 . . . . 0.0 109.08 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -107.95 123.92 49.36 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.777 0.799 . . . . 0.0 110.159 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -96.92 138.3 34.68 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.797 0.808 . . . . 0.0 109.41 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -86.94 -24.29 24.82 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 109.41 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.32 -44.91 93.6 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.432 -0.793 . . . . 0.0 109.543 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.433 ' O ' ' C ' ' A' ' 22' ' ' ARG . 19.7 pt -105.6 9.99 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.449 -0.782 . . . . 0.0 108.994 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.445 ' NH1' ' HZ3' ' A' ' 23' ' ' LYS . 51.8 ptt85 35.8 41.78 0.12 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.655 0.741 . . . . 0.0 110.803 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HZ3' ' NH1' ' A' ' 22' ' ' ARG . 54.6 mttp -146.71 160.63 41.99 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.312 -0.868 . . . . 0.0 110.427 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -85.54 137.48 32.85 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 121.536 0.684 . . . . 0.0 109.854 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.3 m -139.39 151.63 67.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.673 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -45.42 134.3 12.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.429 2.086 . . . . 0.0 112.223 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 71.9 t80 -140.31 113.81 8.64 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.378 -0.826 . . . . 0.0 109.56 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 12' ' ' GLU . . . -138.69 151.12 46.89 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.584 0.707 . . . . 0.0 109.267 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.8 mt -101.74 128.34 48.11 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.481 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 30' ' ' ILE . 95.1 mt -108.62 129.55 62.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.698 ' NE ' HH22 ' A' ' 38' ' ' ARG . 9.4 mmm180 -117.04 136.11 53.21 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.717 0.77 . . . . 0.0 109.356 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -101.89 117.91 35.83 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.759 0.79 . . . . 0.0 109.323 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 6.4 t -77.54 118.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-O 121.606 0.717 . . . . 0.0 109.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 133.34 -24.9 3.69 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.464 ' O ' ' O ' ' A' ' 36' ' ' PRO . 3.3 m -104.15 127.55 28.97 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.367 -1.078 . . . . 0.0 110.349 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.464 ' O ' ' O ' ' A' ' 35' ' ' VAL . 50.8 Cg_exo -50.38 -161.09 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.561 2.174 . . . . 0.0 112.791 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.79 144.61 56.35 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.743 0.783 . . . . 0.0 110.641 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.698 HH22 ' NE ' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -160.96 -172.57 3.52 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.812 0.815 . . . . 0.0 110.362 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.5 m -84.73 131.79 48.42 Favored Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.672 -0.643 . . . . 0.0 109.613 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.58 131.75 17.86 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.509 2.139 . . . . 0.0 112.623 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.49 106.63 52.23 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.783 -0.573 . . . . 0.0 109.583 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.478 ' CB ' ' CE1' ' A' ' 27' ' ' TYR . 59.4 Cg_endo -75.6 146.73 30.89 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.472 2.114 . . . . 0.0 112.242 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.15 132.37 53.68 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.612 0.72 . . . . 0.0 109.715 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 p -136.41 167.13 21.91 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.389 0.614 . . . . 0.0 109.605 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -131.65 142.14 44.2 Favored Pre-proline 0 N--CA 1.492 1.657 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -45.98 -35.26 14.03 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.197 1.931 . . . . 0.0 111.576 178.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.48 144.67 56.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.52 -0.738 . . . . 0.0 110.01 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -125.51 148.11 49.0 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.66 0.743 . . . . 0.0 109.847 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.67 129.85 33.39 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.745 0.783 . . . . 0.0 109.497 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 64.7 t0 -66.86 -35.66 80.54 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.563 0.697 . . . . 0.0 109.523 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 72.4 mt -75.21 135.41 41.03 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.953 0.882 . . . . 0.0 110.342 -179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 56' ' ' GLU . 1.7 tm-20 -72.47 -40.05 67.25 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.717 0.77 . . . . 0.0 109.715 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.2 96.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.394 -0.816 . . . . 0.0 109.872 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -64.17 -36.49 84.21 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.323 -0.86 . . . . 0.0 109.25 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.64 89.68 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.403 -0.811 . . . . 0.0 109.182 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 52' ' ' GLU . 97.2 mt-10 -64.39 -45.3 88.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.433 -0.792 . . . . 0.0 109.491 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -64.32 -43.86 93.37 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.375 -0.828 . . . . 0.0 109.677 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.3 -41.55 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.495 -0.753 . . . . 0.0 109.577 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 95.3 p -57.53 -40.38 78.68 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.409 -0.807 . . . . 0.0 109.686 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.78 -46.07 93.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.187 -0.946 . . . . 0.0 109.471 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.75 -52.64 41.91 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.118 -0.988 . . . . 0.0 109.4 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 92.6 m -59.53 -40.28 86.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.314 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -52.97 -40.13 63.5 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.559 -0.713 . . . . 0.0 109.69 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -61.51 -41.18 96.92 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.222 -0.924 . . . . 0.0 109.311 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.501 ' CD1' ' N ' ' A' ' 65' ' ' ILE . 1.4 mp -63.92 -43.85 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.26 -0.9 . . . . 0.0 109.542 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.89 -43.22 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.26 -0.9 . . . . 0.0 109.131 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.3 mt -62.77 -43.78 99.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.213 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -64.32 -43.73 93.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.399 -0.813 . . . . 0.0 109.395 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.524 ' O ' ' N ' ' A' ' 73' ' ' ARG . 15.8 m -63.57 -35.92 82.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.443 -0.785 . . . . 0.0 109.389 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.527 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 64.0 t60 -58.83 -42.86 90.25 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.365 -0.834 . . . . 0.0 109.621 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.445 ' CD1' ' NH2' ' A' ' 7' ' ' ARG . 96.3 mt -63.72 -41.25 98.11 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.356 -0.84 . . . . 0.0 109.093 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -85.51 -70.59 0.58 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 109.229 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 69' ' ' SER . 85.9 mtp180 -79.78 145.34 32.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.384 -0.823 . . . . 0.0 110.439 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -124.2 28.69 6.64 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.629 ' C ' ' H ' ' A' ' 77' ' ' GLY . 98.1 m-20 -84.59 89.66 7.5 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.359 -0.838 . . . . 0.0 109.74 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 64.54 -24.76 0.08 Allowed 'General case' 0 N--CA 1.501 2.079 0 CA-C-O 121.428 0.632 . . . . 0.0 110.268 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.629 ' H ' ' C ' ' A' ' 75' ' ' ASP . . . -51.68 109.29 0.78 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 77' ' ' GLY . 47.5 mt 37.63 34.59 0.05 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.83 0.824 . . . . 0.0 109.575 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.97 85.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.498 -0.751 . . . . 0.0 109.741 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -64.82 -35.43 81.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.213 -0.93 . . . . 0.0 109.186 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.481 ' CD2' ' NE ' ' A' ' 38' ' ' ARG . 82.4 mt -82.96 -4.41 58.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.209 -0.932 . . . . 0.0 109.257 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.468 0 CA-C-O 117.881 -1.51 . . . . 0.0 109.566 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.488 ' O ' ' N ' ' A' ' 3' ' ' VAL . 88.9 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 1' ' ' MET . 99.6 m-20 40.79 -93.57 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.636 -0.665 . . . . 0.0 110.578 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.488 ' N ' ' O ' ' A' ' 1' ' ' MET . 29.0 m -111.48 131.45 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.579 -0.7 . . . . 0.0 109.491 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.92 159.33 15.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.435 -0.791 . . . . 0.0 109.248 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.6 m170 -109.73 143.45 39.51 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.471 -0.768 . . . . 0.0 109.556 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -152.83 124.38 7.74 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.296 -0.878 . . . . 0.0 109.308 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 53.74 26.04 5.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.621 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.31 2.24 87.76 Favored Glycine 0 N--CA 1.495 2.619 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.94 140.58 38.73 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.35 -1.088 . . . . 0.0 109.554 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.514 -0.741 . . . . 0.0 109.41 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.432 HD11 HG22 ' A' ' 11' ' ' ILE . 96.6 mt -124.76 130.01 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -114.98 113.29 44.19 Favored Pre-proline 0 N--CA 1.497 1.925 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.82 157.34 47.82 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.815 1.677 . . . . 0.0 112.79 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.7 -163.78 37.48 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -148.92 146.3 27.81 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.065 -1.256 . . . . 0.0 109.511 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.48 ' CD ' ' N ' ' A' ' 17' ' ' TYR . 6.5 tm0? -167.61 147.29 5.06 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.31 -0.868 . . . . 0.0 109.087 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.48 ' N ' ' CD ' ' A' ' 16' ' ' GLN . 49.5 p90 -107.63 137.86 44.9 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.4 mtp180 -89.04 136.04 33.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.929 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -71.07 -18.99 62.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -62.21 -45.46 93.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.322 -0.861 . . . . 0.0 109.744 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.11 -2.36 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 48.32 50.27 16.73 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.582 -0.699 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -139.55 157.28 46.08 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.408 -0.808 . . . . 0.0 109.07 178.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -85.73 131.66 34.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.626 -0.672 . . . . 0.0 109.78 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.0 148.75 36.63 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.252 -0.905 . . . . 0.0 109.344 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.74 110.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.325 2.016 . . . . 0.0 111.608 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -108.07 113.2 26.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.153 -0.967 . . . . 0.0 109.234 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.49 154.3 49.91 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.4 -0.813 . . . . 0.0 108.858 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.7 mt -109.69 129.64 55.59 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.6 mt -107.23 128.64 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.683 -0.636 . . . . 0.0 109.399 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -130.43 138.48 50.34 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -82.41 137.98 34.56 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.405 -0.81 . . . . 0.0 109.498 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.1 t -69.28 101.91 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.403 -0.811 . . . . 0.0 109.851 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 137.23 -21.65 3.28 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.412 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 15.9 m -152.04 55.12 1.45 Allowed Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.153 -1.204 . . . . 0.0 109.959 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 57.6 Cg_endo -72.28 -11.64 26.97 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.354 2.036 . . . . 0.0 111.36 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -74.87 -2.85 28.66 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.439 -0.788 . . . . 0.0 109.534 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.446 ' O ' ' C ' ' A' ' 39' ' ' THR . 24.1 mmm180 -81.18 132.65 35.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.173 -0.954 . . . . 0.0 109.197 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.446 ' C ' ' O ' ' A' ' 38' ' ' ARG . 88.6 m -33.67 97.61 0.12 Allowed Pre-proline 0 N--CA 1.5 2.047 0 O-C-N 122.113 -0.367 . . . . 0.0 110.147 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.63 143.42 68.91 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.124 1.882 . . . . 0.0 112.326 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 24.2 mm -106.01 130.76 22.48 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.313 -0.867 . . . . 0.0 108.734 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.2 148.49 39.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.763 1.642 . . . . 0.0 112.121 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.2 t -120.43 133.58 55.4 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.3 p -136.19 167.75 20.69 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -128.33 143.72 49.18 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.542 -0.724 . . . . 0.0 109.388 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -44.04 -27.36 1.75 Allowed 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 121.939 1.759 . . . . 0.0 112.008 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.24 165.01 14.67 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.396 -0.815 . . . . 0.0 109.917 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -128.4 148.06 50.68 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -150.61 110.88 4.17 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.084 -1.01 . . . . 0.0 109.667 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 68.3 t0 -66.69 -33.58 75.95 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.692 -0.63 . . . . 0.0 109.938 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.0 mt -79.35 138.19 37.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.165 -0.96 . . . . 0.0 110.953 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -70.74 -36.88 73.36 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.567 0.699 . . . . 0.0 109.416 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.29 -49.26 77.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.91 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.59 -36.18 83.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.381 -0.824 . . . . 0.0 108.938 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.25 97.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.33 -0.856 . . . . 0.0 109.563 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.16 -50.02 65.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.271 -0.893 . . . . 0.0 110.194 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -62.92 -44.57 95.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.281 -0.887 . . . . 0.0 109.647 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.28 -42.39 93.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.351 -0.843 . . . . 0.0 109.733 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 93.8 p -55.82 -40.51 72.87 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.711 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.3 -45.32 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.053 -1.029 . . . . 0.0 109.457 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.31 -49.19 62.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.351 -0.843 . . . . 0.0 109.681 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.9 m -62.91 -34.79 78.18 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.529 -0.732 . . . . 0.0 109.436 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.8 -41.8 92.02 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.377 -0.827 . . . . 0.0 109.353 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -62.92 -44.7 95.37 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.197 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.59 -43.51 86.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.481 -0.762 . . . . 0.0 109.21 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.1 mm -62.31 -44.74 99.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.55 -45.05 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.035 -1.041 . . . . 0.0 109.603 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -67.08 -51.59 52.48 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.863 . . . . 0.0 109.741 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.505 ' O ' ' N ' ' A' ' 73' ' ' ARG . 58.9 m -62.09 -41.45 98.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 109.349 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.667 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 55.7 t60 -53.19 -43.79 67.43 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.376 -0.827 . . . . 0.0 109.432 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.4 mt -62.61 -42.03 99.33 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.352 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -98.99 16.85 21.2 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.36 -0.837 . . . . 0.0 109.997 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 69' ' ' SER . 71.4 ttt180 -159.35 125.38 4.38 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.205 -0.934 . . . . 0.0 110.134 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.405 ' O ' ' O ' ' A' ' 73' ' ' ARG . 11.0 m-70 44.57 94.43 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.549 -0.72 . . . . 0.0 110.334 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -81.58 -5.37 57.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.256 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.406 ' O ' ' O ' ' A' ' 77' ' ' GLY . 6.8 tm0? -67.11 -35.45 79.8 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.886 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.483 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . -44.45 -97.21 0.01 OUTLIER Glycine 0 N--CA 1.493 2.452 0 O-C-N 121.358 -0.839 . . . . 0.0 111.227 -178.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.667 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 45.8 mt -73.61 37.03 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.129 -1.218 . . . . 0.0 110.21 -178.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -65.44 -35.62 81.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.362 -0.837 . . . . 0.0 109.768 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -62.57 -35.44 79.52 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.383 -0.823 . . . . 0.0 108.986 -179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.24 -2.64 53.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.409 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.584 179.734 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.492 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -149.97 19.92 0.88 Allowed 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 m -82.57 154.83 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.56 138.23 50.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.586 0.708 . . . . 0.0 109.478 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -91.67 138.91 31.18 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.524 0.678 . . . . 0.0 110.04 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -149.4 121.87 8.51 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.532 -0.73 . . . . 0.0 109.608 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 52.89 29.17 7.36 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.623 0.725 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.97 1.37 88.83 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -105.06 139.86 39.1 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.458 -1.025 . . . . 0.0 109.895 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -87.4 139.67 30.32 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 11' ' ' ILE . 97.9 mt -123.16 129.83 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 121.387 0.613 . . . . 0.0 109.463 -179.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -121.05 92.46 48.51 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.68 148.35 22.76 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.759 2.306 . . . . 0.0 112.801 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.95 161.83 29.77 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -93.88 124.98 38.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.642 -0.917 . . . . 0.0 109.921 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -149.4 153.53 37.51 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.613 -0.679 . . . . 0.0 109.514 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -108.32 136.74 47.46 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.614 0.721 . . . . 0.0 109.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -96.39 138.74 33.53 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.631 0.729 . . . . 0.0 109.756 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.72 -24.59 65.39 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.542 0.687 . . . . 0.0 109.804 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -61.09 -45.1 96.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 110.335 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.9 pt -110.25 -5.07 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.404 -0.81 . . . . 0.0 109.313 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 49.14 42.23 20.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.658 0.742 . . . . 0.0 109.873 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -144.57 165.4 28.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 110.098 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -85.26 128.31 34.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.619 0.723 . . . . 0.0 110.043 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.7 m -146.82 148.07 31.85 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.531 -0.73 . . . . 0.0 109.192 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -40.93 110.31 0.12 Allowed 'Trans proline' 0 C--N 1.315 -1.223 0 C-N-CA 122.503 2.135 . . . . 0.0 112.091 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -114.59 119.87 38.24 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.67 145.05 39.94 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.61 -0.681 . . . . 0.0 109.259 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.4 mt -106.27 131.93 52.91 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.401 HD12 HG23 ' A' ' 30' ' ' ILE . 96.4 mt -114.7 127.46 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 CA-C-O 121.374 0.607 . . . . 0.0 109.487 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -134.26 133.97 41.4 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.451 0.643 . . . . 0.0 109.267 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -81.97 137.63 35.1 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.643 0.735 . . . . 0.0 110.15 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.0 t -68.56 133.3 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.607 0.717 . . . . 0.0 110.192 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.16 -22.86 35.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.41 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 19.1 m -154.85 54.7 1.07 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.28 -1.129 . . . . 0.0 110.32 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.41 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 58.4 Cg_endo -72.31 -12.74 27.78 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.529 2.153 . . . . 0.0 110.916 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -87.39 40.17 0.91 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.6 -0.688 . . . . 0.0 109.908 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -114.12 55.53 0.73 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.487 -0.758 . . . . 0.0 109.348 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m 43.15 82.59 0.22 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.966 -0.459 . . . . 0.0 109.775 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.59 143.66 77.96 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.77 2.313 . . . . 0.0 112.528 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.38 130.96 24.09 Favored Pre-proline 0 N--CA 1.491 1.593 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.51 149.01 38.54 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.469 2.113 . . . . 0.0 112.461 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -111.09 133.01 53.79 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -134.85 162.06 33.47 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.611 0.72 . . . . 0.0 109.574 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.623 ' O ' ' N ' ' A' ' 47' ' ' GLU . 12.9 t80 -143.15 135.25 13.19 Favored Pre-proline 0 N--CA 1.487 1.416 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -43.29 76.73 0.01 OUTLIER 'Trans proline' 0 N--CA 1.499 1.797 0 C-N-CA 122.857 2.371 . . . . 0.0 112.207 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.623 ' N ' ' O ' ' A' ' 45' ' ' TYR . 71.1 mm-40 -148.91 148.39 29.78 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.481 -0.762 . . . . 0.0 109.387 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -127.31 118.91 25.1 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -140.51 131.1 25.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.636 -0.665 . . . . 0.0 109.812 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -91.35 -25.43 19.4 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -76.16 143.6 41.06 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.64 0.733 . . . . 0.0 109.972 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -73.1 -40.64 64.82 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.43 0.633 . . . . 0.0 110.176 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.05 92.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.368 -0.832 . . . . 0.0 109.853 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.11 -42.49 96.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.359 -0.838 . . . . 0.0 109.839 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.76 -43.57 88.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.387 -0.821 . . . . 0.0 109.825 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.99 -44.89 75.58 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.804 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -63.85 -45.56 88.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.477 -0.765 . . . . 0.0 109.725 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.13 -42.16 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.579 -0.7 . . . . 0.0 109.777 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 77.9 p -54.73 -41.62 70.58 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.442 -0.786 . . . . 0.0 109.856 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.66 -44.62 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 109.481 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.09 91.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.391 -0.818 . . . . 0.0 109.654 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.35 -46.41 73.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.326 -0.859 . . . . 0.0 109.701 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.37 -43.41 44.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.438 -0.789 . . . . 0.0 109.502 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.74 -42.59 97.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.577 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.412 HG23 HD12 ' A' ' 65' ' ' ILE . 97.4 mt -65.3 -44.64 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.387 -0.821 . . . . 0.0 109.997 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.2 -44.59 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.489 -0.757 . . . . 0.0 109.314 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.4 mt -64.7 -44.33 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -66.15 -44.22 84.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.505 -0.747 . . . . 0.0 109.906 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 73' ' ' ARG . 43.3 t -65.66 -40.36 92.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.358 -0.839 . . . . 0.0 110.1 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -59.23 -42.1 90.25 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.903 . . . . 0.0 109.673 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.8 -42.97 99.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.445 -0.784 . . . . 0.0 109.858 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -84.1 -19.94 33.42 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.382 -0.824 . . . . 0.0 109.584 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 69' ' ' SER . 84.8 mtt85 -141.68 93.45 2.56 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.304 -0.873 . . . . 0.0 109.364 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.445 ' O ' ' N ' ' A' ' 76' ' ' GLN . 93.6 m-70 -57.38 -44.54 84.56 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.615 -0.678 . . . . 0.0 109.214 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' HIS . 98.2 m-20 36.42 -96.75 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.677 0.751 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 74' ' ' HIS . 12.0 tp-100 -169.62 97.06 0.31 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.458 -0.776 . . . . 0.0 109.324 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -75.0 0.02 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -102.91 17.1 24.79 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.377 -1.072 . . . . 0.0 109.682 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.49 -28.3 69.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.323 -0.86 . . . . 0.0 109.335 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.404 ' OD1' ' O ' ' A' ' 80' ' ' ASP . 68.0 t0 -64.16 -32.96 74.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.535 -0.728 . . . . 0.0 109.518 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.6 mt -79.59 -3.94 49.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.37 -0.831 . . . . 0.0 109.797 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.019 -1.434 . . . . 0.0 109.744 179.908 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.469 ' N ' ' SD ' ' A' ' 1' ' ' MET . 2.2 mpt? . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -65.11 -39.98 93.88 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.58 0.705 . . . . 0.0 109.512 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.2 m -86.71 133.83 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.357 -0.839 . . . . 0.0 110.224 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.68 159.58 15.15 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.525 0.679 . . . . 0.0 109.775 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -111.64 152.98 27.03 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.738 0.78 . . . . 0.0 110.239 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -139.94 -134.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.671 0.748 . . . . 0.0 109.934 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -72.65 51.99 0.28 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.754 0.788 . . . . 0.0 110.067 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.87 -6.86 82.64 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -105.99 138.7 41.72 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.339 -1.095 . . . . 0.0 110.34 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -85.6 144.7 27.73 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.359 0.599 . . . . 0.0 109.498 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.9 mt -125.32 132.1 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 121.5 0.667 . . . . 0.0 109.877 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -126.03 124.29 24.63 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.1 157.18 38.25 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.608 2.205 . . . . 0.0 112.729 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.69 -169.32 42.26 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.509 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 47.4 p-80 -148.76 146.85 28.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.768 -0.842 . . . . 0.0 109.767 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -169.78 151.35 4.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -109.3 142.95 39.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 121.887 0.851 . . . . 0.0 110.261 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -94.58 136.23 35.12 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.869 0.843 . . . . 0.0 109.477 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 42.3 p30 -68.0 -20.0 64.98 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.424 0.631 . . . . 0.0 109.673 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 98.9 m-20 -62.38 -42.16 99.2 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.5 -0.75 . . . . 0.0 109.639 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.2 pt -115.56 -3.13 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.573 -0.704 . . . . 0.0 109.281 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 49.16 40.54 17.92 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.632 -0.667 . . . . 0.0 109.988 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -135.83 161.16 36.39 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.651 0.739 . . . . 0.0 110.38 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -86.44 128.33 34.94 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 121.574 0.702 . . . . 0.0 109.85 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -137.3 147.6 58.8 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.97 108.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.248 0 C-N-CA 122.631 2.221 . . . . 0.0 112.057 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -106.33 116.97 32.85 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.487 0.66 . . . . 0.0 109.645 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -135.11 141.78 46.08 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.681 0.753 . . . . 0.0 109.079 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.2 mt -105.08 127.08 52.72 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.65 0.738 . . . . 0.0 109.309 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -115.16 130.46 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.458 0.647 . . . . 0.0 109.465 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.96 134.85 47.72 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.912 0.863 . . . . 0.0 109.672 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -82.6 137.33 34.56 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.872 0.844 . . . . 0.0 110.202 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.9 t -69.13 132.64 32.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.676 0.751 . . . . 0.0 110.199 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.89 -25.11 25.01 Favored Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -152.73 66.89 6.41 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.384 -1.068 . . . . 0.0 109.852 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.4 ' O ' ' O ' ' A' ' 37' ' ' ASP . 36.8 Cg_exo -57.24 -35.08 98.84 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.41 2.073 . . . . 0.0 111.028 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.6 ' C ' ' H ' ' A' ' 39' ' ' THR . 82.8 m-20 -61.05 -127.63 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.41 0.624 . . . . 0.0 110.228 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.534 ' NE ' ' O ' ' A' ' 80' ' ' ASP . 83.3 mtp180 57.33 2.2 0.13 Allowed 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.567 0.699 . . . . 0.0 109.521 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.6 ' H ' ' C ' ' A' ' 37' ' ' ASP . 1.3 m 77.55 101.65 0.03 OUTLIER Pre-proline 0 C--N 1.293 -1.877 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.64 145.53 29.86 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.18 1.92 . . . . 0.0 112.427 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.9 mm -114.82 95.39 41.04 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.17 142.94 43.91 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.7 2.267 . . . . 0.0 112.447 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.74 138.38 44.09 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.692 0.758 . . . . 0.0 110.102 -179.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.2 p -139.24 166.65 23.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.497 0.665 . . . . 0.0 109.48 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.59 ' O ' ' N ' ' A' ' 47' ' ' GLU . 39.9 t80 -137.66 138.29 23.9 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.33 72.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.776 0 C-N-CA 122.863 2.375 . . . . 0.0 112.337 178.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.59 ' N ' ' O ' ' A' ' 45' ' ' TYR . 17.3 pt-20 -173.06 143.45 1.15 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.393 -0.817 . . . . 0.0 109.313 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -125.2 149.61 47.78 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.678 0.752 . . . . 0.0 109.832 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -137.77 131.3 31.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.609 0.719 . . . . 0.0 109.6 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -74.1 -16.4 61.02 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -96.6 130.56 43.77 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.791 0.805 . . . . 0.0 109.443 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.509 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 83.3 tt0 -69.02 -37.36 78.6 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.262 0.553 . . . . 0.0 110.397 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.84 95.1 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.188 -0.945 . . . . 0.0 109.649 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.96 -39.84 95.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.538 -0.726 . . . . 0.0 109.432 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.79 -40.02 94.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.531 -0.731 . . . . 0.0 109.788 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.05 -48.43 68.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.441 -0.787 . . . . 0.0 110.016 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.8 ttp85 -64.11 -44.55 91.92 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.766 0.793 . . . . 0.0 109.767 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.37 -41.9 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.579 -0.7 . . . . 0.0 109.659 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.3 p -57.9 -40.15 79.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.46 -0.775 . . . . 0.0 109.681 -179.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.17 -44.17 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 109.244 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.72 82.55 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.68 0.752 . . . . 0.0 109.405 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.512 ' SG ' ' N ' ' A' ' 63' ' ' ALA . 1.2 p -66.13 -36.96 84.51 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.821 0.82 . . . . 0.0 109.373 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.512 ' N ' ' SG ' ' A' ' 62' ' ' CYS . . . -60.89 -44.83 96.58 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.528 0.68 . . . . 0.0 109.473 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.96 -42.51 97.26 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.607 0.718 . . . . 0.0 109.513 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.48 -43.18 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.555 -0.716 . . . . 0.0 109.736 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.78 -43.22 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.353 -0.842 . . . . 0.0 109.652 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.4 -44.12 98.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.576 -0.703 . . . . 0.0 109.432 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -67.8 -40.54 83.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.358 -0.838 . . . . 0.0 109.314 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 73' ' ' ARG . 66.8 m -63.43 -42.22 98.7 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.619 -0.675 . . . . 0.0 110.098 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.75 -47.34 85.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.251 -0.905 . . . . 0.0 109.811 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.95 -41.45 95.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.523 -0.736 . . . . 0.0 109.412 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -90.83 -77.13 0.42 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 109.967 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 69' ' ' SER . 60.9 ttm-85 -65.0 -106.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.607 -0.683 . . . . 0.0 110.176 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.607 ' CE1' ' H ' ' A' ' 76' ' ' GLN . 47.6 t-80 -178.97 -100.47 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 121.504 0.669 . . . . 0.0 109.197 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.579 ' N ' ' ND1' ' A' ' 74' ' ' HIS . 99.6 m-20 55.33 33.13 20.11 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-O 121.744 0.783 . . . . 0.0 109.378 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.607 ' H ' ' CE1' ' A' ' 74' ' ' HIS . 43.1 tt0 46.16 -128.15 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.765 0.793 . . . . 0.0 110.024 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.565 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . 59.1 139.85 0.01 OUTLIER Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.2 mt 60.65 0.0 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.712 0.768 . . . . 0.0 109.244 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.565 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.44 -39.71 94.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.481 -0.762 . . . . 0.0 109.458 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.534 ' O ' ' NE ' ' A' ' 38' ' ' ARG . 97.6 m-20 -69.87 -19.48 63.43 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.491 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 78.1 mt -94.38 1.29 55.86 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.459 ' N ' ' NH2' ' A' ' 38' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.553 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ttt . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -78.52 -78.26 0.15 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.536 -0.727 . . . . 0.0 109.538 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m -85.89 155.05 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.677 0.751 . . . . 0.0 110.379 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.75 135.14 54.96 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.879 0.847 . . . . 0.0 109.965 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -88.14 136.79 32.81 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.726 0.774 . . . . 0.0 110.035 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -149.8 125.02 10.1 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.748 0.785 . . . . 0.0 109.569 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.539 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 23.6 mmt85 54.18 25.8 6.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.42 0.628 . . . . 0.0 109.867 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.72 3.62 83.43 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -107.63 141.24 39.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.859 0.837 . . . . 0.0 110.307 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.6 144.85 27.64 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.8 mt -124.0 129.4 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.714 0.769 . . . . 0.0 110.013 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -129.61 96.54 26.76 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.41 159.63 32.57 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.956 2.438 . . . . 0.0 113.118 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.32 126.86 0.94 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.629 ' NE2' ' CD2' ' A' ' 24' ' ' TYR . 0.3 OUTLIER -67.81 140.74 56.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.639 -0.918 . . . . 0.0 109.987 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.596 ' N ' ' ND1' ' A' ' 15' ' ' HIS . 58.6 tt0 -165.18 150.96 9.68 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 121.815 0.817 . . . . 0.0 109.753 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.55 137.67 40.48 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.793 0.806 . . . . 0.0 109.79 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp85 -97.64 135.73 39.03 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.902 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.0 p-10 -71.86 -18.06 62.09 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.93 -42.29 97.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.699 -0.626 . . . . 0.0 109.436 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 pt -113.57 -7.59 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 51.32 51.3 17.16 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.493 0.663 . . . . 0.0 109.608 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -146.48 169.67 18.43 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.932 0.872 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.629 ' CD2' ' NE2' ' A' ' 15' ' ' HIS . 3.2 m-85 -86.51 124.23 32.6 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.746 0.784 . . . . 0.0 109.314 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.45 155.45 39.18 Favored Pre-proline 0 C--N 1.302 -1.464 0 CA-C-O 121.241 0.544 . . . . 0.0 109.713 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.4 ' CB ' ' OG ' ' A' ' 59' ' ' SER . 19.4 Cg_endo -59.33 136.66 73.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.414 2.076 . . . . 0.0 111.726 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -138.52 116.87 11.94 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.409 0.623 . . . . 0.0 109.39 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -133.52 153.99 51.19 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.727 0.775 . . . . 0.0 110.206 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.8 mt -107.94 131.18 54.81 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.732 0.777 . . . . 0.0 109.845 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 30' ' ' ILE . 89.3 mt -108.85 128.01 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 CA-C-O 121.716 0.77 . . . . 0.0 109.446 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -135.67 134.96 39.73 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.734 0.778 . . . . 0.0 109.836 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -86.83 134.87 33.51 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.751 0.786 . . . . 0.0 109.994 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 78.7 t -66.47 133.94 30.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.749 0.785 . . . . 0.0 110.503 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 17.82 61.17 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.9 t -146.41 64.38 9.56 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.617 -0.931 . . . . 0.0 109.805 179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.41 ' O ' ' C ' ' A' ' 37' ' ' ASP . 70.5 Cg_endo -78.75 -170.91 1.09 Allowed 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.868 2.378 . . . . 0.0 112.423 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 36' ' ' PRO . 65.5 t0 37.56 89.34 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.656 0.741 . . . . 0.0 110.569 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.79 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -167.3 -174.37 2.56 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 121.712 0.768 . . . . 0.0 110.009 -179.807 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.5 m -82.62 130.2 59.51 Favored Pre-proline 0 N--CA 1.483 1.179 0 O-C-N 121.885 -0.51 . . . . 0.0 109.628 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.24 133.4 21.06 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.445 2.096 . . . . 0.0 112.349 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 35.5 mm -115.9 84.48 13.25 Favored Pre-proline 0 N--CA 1.495 1.803 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -70.32 144.57 51.45 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 122.539 2.159 . . . . 0.0 112.55 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.7 t -105.39 135.27 47.08 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.902 0.858 . . . . 0.0 109.757 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 166.73 22.37 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.701 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.456 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.1 OUTLIER -126.03 146.93 57.4 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -70.62 -12.08 30.71 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 122.628 2.218 . . . . 0.0 111.513 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -78.01 -178.1 5.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.607 -0.683 . . . . 0.0 110.021 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -130.44 147.58 52.16 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.903 0.859 . . . . 0.0 109.984 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -149.34 98.24 2.77 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.615 0.722 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -71.26 -17.3 62.49 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.1 mt -91.27 132.34 36.2 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.807 0.813 . . . . 0.0 109.754 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -67.83 -39.51 83.89 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.8 75.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.683 -0.636 . . . . 0.0 109.927 -179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.84 -38.67 91.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.536 -0.728 . . . . 0.0 109.236 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.402 ' O ' ' OG ' ' A' ' 59' ' ' SER . . . -61.64 -41.92 98.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.754 -0.591 . . . . 0.0 109.419 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -68.14 -47.09 69.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.747 -0.596 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -64.51 -44.05 92.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.604 -0.685 . . . . 0.0 109.665 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.7 t -67.76 -40.74 84.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.682 -0.636 . . . . 0.0 109.344 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 55' ' ' ALA . 64.1 m -54.47 -44.81 72.92 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.543 -0.723 . . . . 0.0 109.684 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.596 -0.69 . . . . 0.0 109.375 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.19 95.02 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.767 -0.583 . . . . 0.0 109.757 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.456 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 86.5 m -67.6 -49.4 63.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.515 -0.741 . . . . 0.0 109.602 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.38 15.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.642 -0.661 . . . . 0.0 109.585 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -65.23 -41.22 94.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.735 -0.603 . . . . 0.0 109.445 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.52 -43.75 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.619 -0.676 . . . . 0.0 109.948 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.03 -44.63 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.99 -44.54 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.602 -0.687 . . . . 0.0 109.449 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.539 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 93.0 m-20 -66.32 -43.73 85.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.473 -0.767 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 73' ' ' ARG . 76.3 p -65.78 -37.46 86.38 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.672 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 84.9 t60 -58.48 -40.71 83.49 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.2 mt -63.84 -41.44 97.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.735 -0.603 . . . . 0.0 109.422 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -102.14 -72.7 0.68 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.652 -0.655 . . . . 0.0 109.742 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 69' ' ' SER . 83.8 mtp180 -87.58 -157.16 0.38 Allowed 'General case' 0 N--CA 1.497 1.904 0 CA-C-O 121.673 0.749 . . . . 0.0 110.446 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.412 ' C ' ' O ' ' A' ' 73' ' ' ARG . 59.3 t-80 38.43 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.565 0.698 . . . . 0.0 110.197 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' GLN . 83.6 m-20 -70.31 142.37 52.23 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.57 0.7 . . . . 0.0 109.523 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.425 ' O ' ' O ' ' A' ' 75' ' ' ASP . 50.2 tt0 57.83 152.09 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.797 0.808 . . . . 0.0 110.395 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 151.54 -65.6 0.36 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.672 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 86.6 mt -95.83 12.1 31.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.339 -1.095 . . . . 0.0 108.801 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.73 -39.58 94.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.775 -0.578 . . . . 0.0 109.49 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -65.38 -35.72 81.82 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.477 -0.764 . . . . 0.0 109.0 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 87.2 mt -86.22 -5.2 59.24 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.806 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 -179.687 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -116.12 47.75 1.35 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.567 -0.708 . . . . 0.0 109.188 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.17 136.79 24.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.371 -0.83 . . . . 0.0 109.621 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.89 163.71 13.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.109 -0.995 . . . . 0.0 109.528 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -118.65 144.47 46.15 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.677 -0.64 . . . . 0.0 109.471 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -153.04 119.85 5.71 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.276 -0.89 . . . . 0.0 109.713 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 52.28 31.06 8.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.468 -0.77 . . . . 0.0 110.151 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.67 3.32 83.84 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 120.142 -1.028 . . . . 0.0 110.663 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -106.26 136.26 46.3 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.238 -1.154 . . . . 0.0 109.52 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -91.17 145.64 24.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.273 -0.892 . . . . 0.0 108.984 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.1 mt -118.72 128.64 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.684 -0.635 . . . . 0.0 109.709 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -123.8 94.16 46.32 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.08 162.14 32.01 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.868 1.712 . . . . 0.0 112.76 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.533 ' O ' ' ND1' ' A' ' 15' ' ' HIS . . . 179.5 -25.1 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.533 ' ND1' ' O ' ' A' ' 14' ' ' GLY . 0.1 OUTLIER 74.22 155.4 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.532 -0.981 . . . . 0.0 109.723 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -170.44 155.93 5.32 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -105.64 137.12 44.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.362 -0.836 . . . . 0.0 108.788 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -94.26 136.04 34.99 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.149 -0.97 . . . . 0.0 109.722 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 39.8 p30 -68.77 -20.69 64.36 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.478 -0.764 . . . . 0.0 109.552 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.528 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 30.4 t70 -59.29 -49.41 77.96 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.076 -1.015 . . . . 0.0 109.234 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.4 pt -105.71 -4.07 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.453 -0.78 . . . . 0.0 109.571 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 49.0 49.05 20.05 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.69 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -145.6 165.99 27.05 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.299 -0.876 . . . . 0.0 109.593 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -88.54 127.19 35.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.54 -0.725 . . . . 0.0 109.462 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.93 153.31 49.64 Favored Pre-proline 0 N--CA 1.492 1.66 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -43.45 130.97 6.99 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 121.537 1.491 . . . . 0.0 112.096 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -150.99 113.92 4.75 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -141.0 163.57 32.61 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.35 -0.844 . . . . 0.0 109.668 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.0 mt -106.26 131.42 53.51 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -115.94 132.26 65.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.618 -0.677 . . . . 0.0 109.89 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -126.02 136.96 53.57 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -96.81 124.38 40.77 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 74.1 t -65.87 -42.17 91.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.484 -0.76 . . . . 0.0 109.79 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.98 -49.52 6.25 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -178.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.48 ' O ' ' O ' ' A' ' 36' ' ' PRO . 7.4 m -97.32 152.27 38.15 Favored Pre-proline 0 N--CA 1.5 2.051 0 O-C-N 120.946 -1.326 . . . . 0.0 109.638 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' VAL . 81.0 Cg_exo -47.38 -164.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.5 1.874 0 C-N-CA 122.608 2.205 . . . . 0.0 113.434 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -80.77 98.46 7.79 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.391 -0.818 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -105.13 157.36 17.31 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.474 -0.766 . . . . 0.0 109.096 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 29.1 m -44.84 133.84 5.02 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.803 . . . . 0.0 109.409 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.02 148.3 44.76 Favored 'Trans proline' 0 C--N 1.314 -1.245 0 C-N-CA 121.391 1.394 . . . . 0.0 111.296 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.4 mm -114.02 132.82 22.5 Favored Pre-proline 0 N--CA 1.498 1.935 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -74.4 150.21 40.95 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 121.752 1.635 . . . . 0.0 112.491 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.07 131.63 49.07 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.0 p -136.55 164.86 27.19 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.632 -0.668 . . . . 0.0 109.422 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 47' ' ' GLU . 77.7 t80 -138.12 121.63 11.39 Favored Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -43.15 82.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.196 1.931 . . . . 0.0 113.288 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 45' ' ' TYR . 47.3 tp10 -168.56 151.57 5.37 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.02 148.56 30.59 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.091 -1.005 . . . . 0.0 111.574 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.47 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 66.7 m-85 -157.05 104.76 2.1 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 25.6 p-10 -74.72 -6.39 48.53 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.177 -0.952 . . . . 0.0 110.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 84.3 mt -102.74 130.32 49.66 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.053 -1.03 . . . . 0.0 110.23 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -66.35 -40.25 89.69 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.472 -0.768 . . . . 0.0 109.279 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -50.88 71.0 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.049 -1.032 . . . . 0.0 109.47 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.47 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.7 t0 -65.47 -39.2 91.7 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.12 -0.988 . . . . 0.0 109.232 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.59 98.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.818 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.31 -43.81 85.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.05 -1.031 . . . . 0.0 109.315 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpp85 -62.53 -46.66 87.39 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.274 -0.891 . . . . 0.0 109.192 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.1 t -66.8 -42.62 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.565 -0.71 . . . . 0.0 109.781 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -56.01 -41.48 74.98 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.112 -0.993 . . . . 0.0 109.696 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.97 -44.66 97.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 O-C-N 121.134 -0.979 . . . . 0.0 109.238 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.9 -41.58 82.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.37 -39.79 85.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.302 -0.874 . . . . 0.0 109.786 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.94 -44.84 82.92 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.342 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.87 -42.1 97.6 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.144 -0.973 . . . . 0.0 109.737 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.1 mt -64.06 -43.56 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.175 -0.953 . . . . 0.0 109.629 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 30.1 mm -63.29 -43.14 98.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.295 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.87 -44.82 99.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 121.173 -0.955 . . . . 0.0 109.4 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -65.78 -45.91 80.69 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.122 -0.986 . . . . 0.0 109.15 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.5 m -62.19 -39.02 91.33 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.428 -0.795 . . . . 0.0 109.75 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.406 ' CE1' ' N ' ' A' ' 79' ' ' ALA . 86.4 t60 -58.93 -50.16 75.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.121 -0.987 . . . . 0.0 110.219 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.52 -43.23 94.69 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.086 -1.009 . . . . 0.0 109.329 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -66.42 -42.63 87.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.224 -0.922 . . . . 0.0 110.12 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.48 ' O ' ' CB ' ' A' ' 74' ' ' HIS . 33.9 ptt-85 -161.77 -155.11 0.37 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 0.0 109.923 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.48 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 11.8 t-80 81.35 136.3 0.06 Allowed 'General case' 0 N--CA 1.498 1.963 0 CA-C-O 121.231 0.538 . . . . 0.0 109.79 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -86.5 -76.27 0.36 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.443 -0.786 . . . . 0.0 109.521 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.33 -109.31 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.286 -0.884 . . . . 0.0 109.16 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.32 -126.44 40.05 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 mt -94.32 31.79 1.66 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.382 -1.069 . . . . 0.0 109.496 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.406 ' N ' ' CE1' ' A' ' 70' ' ' HIS . . . -61.57 -36.2 79.95 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 0.0 109.748 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.87 -38.15 87.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.119 -0.988 . . . . 0.0 109.401 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.1 mt -83.23 -2.95 56.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.155 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 117.989 -1.451 . . . . 0.0 109.549 179.994 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.2 mtp . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 58.79 34.51 23.77 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 19.5 m -89.96 154.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.92 0.867 . . . . 0.0 110.755 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.06 134.19 55.06 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.855 0.836 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -81.97 146.91 29.5 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.701 0.763 . . . . 0.0 110.373 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.64 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 15.8 t80 -154.32 113.95 3.78 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.582 0.706 . . . . 0.0 109.423 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.64 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 46.57 36.1 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.684 0.754 . . . . 0.0 110.184 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.11 -20.08 38.78 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 6' ' ' TYR . 93.4 m-85 -86.76 137.37 32.49 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.379 -1.071 . . . . 0.0 110.122 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -91.99 149.23 21.65 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.466 0.65 . . . . 0.0 109.312 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 90.7 mt -122.82 132.26 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 CA-C-O 121.724 0.773 . . . . 0.0 109.435 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -120.62 88.49 43.35 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.87 147.37 81.77 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.66 2.24 . . . . 0.0 112.375 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.59 -173.72 35.22 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.507 ' CD2' ' OE2' ' A' ' 52' ' ' GLU . 53.7 p-80 -141.08 122.53 15.0 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.759 0.79 . . . . 0.0 109.964 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -154.6 155.33 34.53 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.907 0.86 . . . . 0.0 110.129 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -110.53 145.94 36.88 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.683 0.754 . . . . 0.0 110.071 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.424 ' HE ' HG22 ' A' ' 44' ' ' THR . 95.0 mtt-85 -101.32 137.67 39.35 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.703 0.763 . . . . 0.0 109.756 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -68.46 -15.27 63.49 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.717 -0.614 . . . . 0.0 109.95 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -62.83 -43.26 99.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.375 -0.828 . . . . 0.0 109.362 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.8 pt -114.96 -7.92 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.1 mmm180 55.17 44.11 28.31 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.433 0.635 . . . . 0.0 110.09 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -141.3 161.08 38.74 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.616 0.722 . . . . 0.0 110.49 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.96 128.67 34.73 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.947 0.879 . . . . 0.0 109.85 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.7 m -140.19 149.18 57.27 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -37.04 108.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.315 -1.196 0 C-N-CA 122.939 2.426 . . . . 0.0 112.387 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -104.78 119.89 40.07 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.669 0.747 . . . . 0.0 109.957 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.86 147.64 33.04 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.835 0.826 . . . . 0.0 109.577 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.8 mt -109.62 133.83 52.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.621 0.724 . . . . 0.0 109.199 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 mm -103.18 123.05 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.437 HH22 ' C ' ' A' ' 36' ' ' PRO . 20.8 mmm180 -127.94 137.31 52.22 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.9 0.857 . . . . 0.0 110.22 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -101.89 141.56 34.56 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.899 0.857 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.8 t -60.78 132.73 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-O 121.952 0.882 . . . . 0.0 110.637 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 80.15 20.36 67.53 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.401 ' O ' ' O ' ' A' ' 36' ' ' PRO . 23.0 t -133.06 82.38 54.64 Favored Pre-proline 0 N--CA 1.502 2.145 0 O-C-N 121.308 -1.113 . . . . 0.0 109.665 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.437 ' C ' HH22 ' A' ' 31' ' ' ARG . 51.5 Cg_exo -53.07 -160.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.707 2.272 . . . . 0.0 112.468 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -52.45 110.84 0.54 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.611 0.72 . . . . 0.0 110.108 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 mmm180 -137.99 62.28 1.57 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 121.563 0.697 . . . . 0.0 109.426 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 m 50.64 79.66 0.33 Allowed Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -57.92 145.34 91.56 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.487 2.125 . . . . 0.0 112.515 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -127.32 89.26 51.99 Favored Pre-proline 0 N--CA 1.493 1.676 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.39 143.05 56.08 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.702 2.268 . . . . 0.0 112.833 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.8 t -105.32 134.83 47.77 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.821 0.819 . . . . 0.0 109.831 -179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.424 HG22 ' HE ' ' A' ' 18' ' ' ARG . 47.0 p -141.2 167.26 22.61 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.54 0.686 . . . . 0.0 109.871 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.578 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.5 OUTLIER -128.44 146.49 60.07 Favored Pre-proline 0 N--CA 1.486 1.367 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -48.99 -37.18 36.71 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 122.058 1.839 . . . . 0.0 111.271 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -45.55 150.55 0.48 Allowed 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.798 0.808 . . . . 0.0 110.15 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -121.85 139.6 53.42 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.822 0.82 . . . . 0.0 110.045 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -141.66 111.93 6.92 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.686 0.755 . . . . 0.0 109.341 179.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.49 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 20.1 p-10 -68.32 -33.08 73.66 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.76 136.68 39.02 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.014 0.911 . . . . 0.0 109.942 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.507 ' OE2' ' CD2' ' A' ' 15' ' ' HIS . 43.6 tt0 -70.71 -37.07 73.52 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.765 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.71 -39.19 93.28 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.556 -0.715 . . . . 0.0 110.326 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -65.16 -38.97 92.25 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.45 -0.781 . . . . 0.0 109.362 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.91 89.19 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.614 -0.679 . . . . 0.0 109.819 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -66.85 -47.64 71.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.472 -0.768 . . . . 0.0 109.768 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -66.17 -44.1 85.03 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 121.47 0.652 . . . . 0.0 109.865 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.5 t -66.98 -41.28 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 109.575 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.0 p -57.87 -39.47 77.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.573 -0.704 . . . . 0.0 109.715 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.0 -45.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.62 -39.18 77.34 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.497 0.665 . . . . 0.0 109.764 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.578 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 5.9 t -70.92 -37.36 72.9 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.478 -0.764 . . . . 0.0 109.662 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.86 87.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.69 -0.631 . . . . 0.0 109.711 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -64.02 -42.93 96.96 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.563 0.697 . . . . 0.0 109.293 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.3 mt -65.36 -43.51 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.647 -0.658 . . . . 0.0 109.642 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -64.22 -44.18 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 110.104 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.2 mt -65.1 -43.68 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.642 -0.661 . . . . 0.0 109.306 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -66.24 -43.65 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.628 -0.67 . . . . 0.0 109.456 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.0 p -68.27 -36.66 79.74 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.56 0.695 . . . . 0.0 109.435 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.453 ' ND1' ' OD1' ' A' ' 75' ' ' ASP . 84.3 t60 -61.27 -45.29 95.1 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.628 -0.67 . . . . 0.0 109.76 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 81.3 mt -64.65 -42.91 95.09 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.468 0.651 . . . . 0.0 109.639 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -75.55 -17.87 59.94 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -151.38 106.6 3.31 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -72.97 105.67 4.55 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.852 0.834 . . . . 0.0 109.551 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.453 ' OD1' ' ND1' ' A' ' 70' ' ' HIS . 39.6 p-10 -96.94 9.0 43.22 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 67.26 8.57 6.32 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.816 0.817 . . . . 0.0 109.256 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.68 -37.83 89.43 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.98 25.96 10.72 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.716 -0.873 . . . . 0.0 109.64 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.12 79.55 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.353 -0.842 . . . . 0.0 109.426 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.5 -40.81 97.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.445 0.64 . . . . 0.0 109.64 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -84.84 -2.56 57.91 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -179.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.7 mtm . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -82.11 144.68 30.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.6 m -108.63 131.02 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-O 121.839 0.828 . . . . 0.0 110.108 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.44 155.34 17.92 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.546 -0.721 . . . . 0.0 109.509 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -109.52 141.39 42.05 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.71 0.767 . . . . 0.0 109.947 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -153.69 122.59 6.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.41 -0.806 . . . . 0.0 109.21 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 54.83 25.91 7.17 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.634 0.73 . . . . 0.0 110.083 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.48 8.37 77.55 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -110.84 142.94 42.18 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.349 -1.089 . . . . 0.0 110.292 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -91.91 142.34 27.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.407 -0.808 . . . . 0.0 109.438 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.432 HD13 HG22 ' A' ' 11' ' ' ILE . 96.7 mt -123.13 130.62 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.511 -0.743 . . . . 0.0 109.591 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -120.83 94.22 48.87 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -78.26 148.6 24.2 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.608 2.205 . . . . 0.0 113.101 -178.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.78 115.04 0.39 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -55.18 136.91 48.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -1.038 . . . . 0.0 111.034 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -153.59 149.29 27.46 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.467 -0.771 . . . . 0.0 109.32 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -106.78 134.32 50.11 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.858 0.837 . . . . 0.0 110.119 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 94.2 mtt180 -94.13 138.19 32.47 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.538 -0.726 . . . . 0.0 109.786 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -68.66 -20.74 64.47 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.531 -0.731 . . . . 0.0 109.434 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.83 -43.68 95.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.904 . . . . 0.0 109.784 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.417 HD11 HG23 ' A' ' 21' ' ' ILE . 15.1 pt -112.12 -0.31 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' ARG . 90.2 mtm-85 43.28 37.2 1.22 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.64 -0.662 . . . . 0.0 110.401 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -137.48 162.56 33.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.253 -0.905 . . . . 0.0 110.172 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -86.12 128.57 34.9 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.843 0.83 . . . . 0.0 109.85 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.5 m -145.84 147.63 33.16 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -37.27 110.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.707 2.272 . . . . 0.0 112.17 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -119.58 118.42 30.96 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.38 -0.825 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.1 155.0 44.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.312 -0.868 . . . . 0.0 109.179 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -111.08 130.28 55.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.731 . . . . 0.0 109.254 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.417 HD13 HG21 ' A' ' 30' ' ' ILE . 98.1 mt -107.11 130.65 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -134.81 138.51 44.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.501 -0.75 . . . . 0.0 109.048 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.53 137.48 32.3 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -0.812 . . . . 0.0 110.196 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 76.7 t -70.11 133.61 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.692 0.758 . . . . 0.0 110.39 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.34 -30.12 10.72 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.447 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 2.3 m -148.59 52.12 1.13 Allowed Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.157 -1.202 . . . . 0.0 109.638 179.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 72.9 Cg_endo -76.29 -10.74 19.21 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.509 2.139 . . . . 0.0 110.591 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 51.9 p-10 -91.03 54.85 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.46 -0.775 . . . . 0.0 109.689 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.58 ' NH2' ' O ' ' A' ' 81' ' ' LEU . 70.0 mtm180 -119.27 -107.24 0.37 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.447 -0.783 . . . . 0.0 110.023 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.6 m -135.09 86.91 30.38 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.495 -0.753 . . . . 0.0 109.052 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -55.19 140.46 81.08 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.763 2.309 . . . . 0.0 112.035 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.88 131.05 24.04 Favored Pre-proline 0 N--CA 1.495 1.777 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.81 142.78 44.11 Favored 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.132 1.888 . . . . 0.0 112.494 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.8 t -119.22 130.22 55.36 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.642 0.734 . . . . 0.0 109.089 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -139.22 167.45 22.05 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.553 ' O ' ' N ' ' A' ' 47' ' ' GLU . 82.6 t80 -120.62 123.8 27.89 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.596 -0.69 . . . . 0.0 109.193 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -43.35 80.54 0.01 OUTLIER 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 122.576 2.184 . . . . 0.0 112.561 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 45' ' ' TYR . 81.2 tt0 -172.69 157.76 3.88 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.266 -0.896 . . . . 0.0 109.028 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -112.09 140.08 47.07 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.361 -0.837 . . . . 0.0 109.486 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.475 ' CZ ' ' OE2' ' A' ' 47' ' ' GLU . 37.7 m-85 -135.7 131.56 35.79 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.38 -0.825 . . . . 0.0 108.9 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -93.32 -23.95 18.3 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.83 137.76 32.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.068 -1.02 . . . . 0.0 110.181 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -71.13 -37.51 72.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.48 -0.762 . . . . 0.0 109.398 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.49 84.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 109.421 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.7 -41.46 98.12 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.405 -0.81 . . . . 0.0 109.506 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.2 96.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 109.981 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.85 -44.25 70.24 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.118 -0.989 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -67.68 -43.01 81.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.162 -0.961 . . . . 0.0 110.027 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.92 -42.68 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.709 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -60.35 -42.15 95.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.623 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 93.7 mt -65.52 -44.47 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.147 -0.971 . . . . 0.0 109.691 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.71 -39.3 80.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.053 -1.03 . . . . 0.0 109.211 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.8 t -69.54 -38.37 77.48 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.406 -0.809 . . . . 0.0 109.625 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.9 -46.13 85.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.48 -43.82 96.21 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.118 -0.989 . . . . 0.0 109.455 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.424 HD12 HG22 ' A' ' 65' ' ' ILE . 96.8 mt -65.57 -43.06 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.908 . . . . 0.0 109.394 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.44 -44.05 98.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.177 -0.952 . . . . 0.0 109.586 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.02 -44.48 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.216 -0.928 . . . . 0.0 109.447 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -66.4 -41.98 88.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.431 -0.793 . . . . 0.0 109.878 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.8 p -67.63 -35.73 79.47 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.237 -0.914 . . . . 0.0 109.692 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.583 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 80.9 t60 -60.64 -43.86 97.08 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.334 -0.854 . . . . 0.0 109.61 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.87 -41.78 97.69 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.863 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -83.48 -77.22 0.26 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.17 -0.956 . . . . 0.0 110.24 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 74' ' ' HIS . 53.4 ttp180 -109.38 -123.78 0.26 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.342 -0.849 . . . . 0.0 109.945 -179.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.415 ' C ' ' O ' ' A' ' 73' ' ' ARG . 15.1 m80 36.69 87.26 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.025 0.917 . . . . 0.0 110.341 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 76' ' ' GLN . 55.3 t0 -71.79 147.82 46.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.432 -0.792 . . . . 0.0 109.818 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.443 ' O ' ' O ' ' A' ' 75' ' ' ASP . 99.4 mm-40 57.5 148.86 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.842 0.829 . . . . 0.0 110.774 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.56 -77.53 0.32 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.583 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 25.1 mt -108.36 24.85 12.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.466 -1.02 . . . . 0.0 109.476 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.86 89.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -64.58 -35.63 81.62 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.306 -0.871 . . . . 0.0 109.485 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.58 ' O ' ' NH2' ' A' ' 38' ' ' ARG . 85.1 mt -83.27 14.74 3.33 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.217 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -74.32 146.78 42.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.417 -0.802 . . . . 0.0 110.362 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.6 m -75.25 135.76 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.436 -0.79 . . . . 0.0 109.907 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.8 157.35 16.18 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -0.842 . . . . 0.0 109.978 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.22 143.43 41.99 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.67 -0.644 . . . . 0.0 109.528 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -155.47 126.3 6.99 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.435 -0.791 . . . . 0.0 109.448 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 53.22 24.75 3.88 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.705 0.764 . . . . 0.0 109.615 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.63 -16.67 55.89 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -84.9 143.17 29.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -1.102 . . . . 0.0 110.49 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -90.12 143.94 26.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.468 -0.77 . . . . 0.0 109.063 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.4 HD12 HG23 ' A' ' 11' ' ' ILE . 96.5 mt -124.3 129.9 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.611 -0.68 . . . . 0.0 109.275 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -115.5 126.34 27.85 Favored Pre-proline 0 N--CA 1.492 1.663 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.93 158.45 38.54 Favored 'Trans proline' 0 N--CA 1.495 1.588 0 C-N-CA 122.351 2.034 . . . . 0.0 113.098 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.3 -176.6 45.26 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -147.79 124.53 11.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.347 -1.09 . . . . 0.0 109.015 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -146.12 157.46 43.84 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.924 . . . . 0.0 109.06 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -106.5 145.9 31.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.624 -0.672 . . . . 0.0 110.175 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.405 HH21 ' CD1' ' A' ' 21' ' ' ILE . 88.9 mtm180 -92.87 140.03 29.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.459 -0.776 . . . . 0.0 110.117 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -67.44 -28.46 67.91 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.396 -0.815 . . . . 0.0 109.534 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -60.26 -49.02 79.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.463 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.405 ' CD1' HH21 ' A' ' 18' ' ' ARG . 18.7 pt -106.29 0.03 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.493 -0.755 . . . . 0.0 109.502 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 43.19 44.71 4.55 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.413 -0.805 . . . . 0.0 109.833 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -137.92 161.41 36.72 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.397 -0.814 . . . . 0.0 110.081 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -84.32 133.41 34.54 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.572 0.701 . . . . 0.0 110.171 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.6 155.25 41.77 Favored Pre-proline 0 N--CA 1.487 1.395 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -42.42 120.47 1.68 Allowed 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 122.167 1.911 . . . . 0.0 111.9 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -126.18 127.98 46.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.704 -0.623 . . . . 0.0 109.747 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -150.99 157.69 43.19 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.307 -0.871 . . . . 0.0 109.2 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 86.0 mt -106.63 135.34 48.32 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -117.35 132.03 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.82 -0.55 . . . . 0.0 109.809 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -131.84 138.6 48.55 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.5 0.667 . . . . 0.0 109.403 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -83.48 135.97 34.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.513 -0.742 . . . . 0.0 110.058 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.3 t -81.57 131.91 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.421 -0.8 . . . . 0.0 110.045 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 132.93 -66.65 0.57 Allowed Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.46 ' O ' ' O ' ' A' ' 36' ' ' PRO . 19.2 m -98.45 151.68 37.58 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.41 -1.053 . . . . 0.0 110.391 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' VAL . 89.0 Cg_exo -47.42 -166.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 122.805 2.337 . . . . 0.0 113.577 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -81.78 106.63 13.87 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.46 -0.775 . . . . 0.0 109.881 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.462 ' O ' ' O ' ' A' ' 39' ' ' THR . 25.2 mmt85 -107.23 83.05 1.76 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.621 0.724 . . . . 0.0 109.157 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 38' ' ' ARG . 9.8 m 47.3 102.2 0.03 OUTLIER Pre-proline 0 N--CA 1.488 1.434 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.108 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.05 146.05 28.63 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 121.957 1.771 . . . . 0.0 112.52 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.7 mm -115.07 93.74 36.11 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.25 140.64 51.54 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.13 1.887 . . . . 0.0 112.068 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 t -99.03 136.14 39.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.422 -0.799 . . . . 0.0 109.631 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -132.47 161.06 34.69 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.541 ' O ' ' O ' ' A' ' 46' ' ' PRO . 4.4 t80 -142.03 140.62 19.87 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 45' ' ' TYR . 76.7 Cg_exo -46.24 -131.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.974 2.449 . . . . 0.0 113.39 178.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' PRO . 58.8 mp0 44.29 -170.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.097 -1.002 . . . . 0.0 110.468 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 49' ' ' TYR . 71.2 m-85 -145.7 149.3 34.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.145 -0.972 . . . . 0.0 109.8 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.413 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 64.1 m-85 -146.9 105.94 3.87 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.475 -0.766 . . . . 0.0 109.133 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -72.65 -17.59 61.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.4 mt -96.53 126.73 41.92 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.81 0.814 . . . . 0.0 109.92 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -69.37 -38.06 77.87 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.457 0.646 . . . . 0.0 109.811 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -46.63 87.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.369 -0.832 . . . . 0.0 109.745 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -65.2 -36.03 82.9 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.486 -0.759 . . . . 0.0 109.475 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.418 ' O ' ' OG ' ' A' ' 59' ' ' SER . . . -63.33 -38.74 92.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.315 -0.866 . . . . 0.0 109.433 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.77 -48.07 78.41 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.883 . . . . 0.0 109.594 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -46.1 89.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 109.289 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.8 t -64.0 -42.69 96.5 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.729 -0.607 . . . . 0.0 109.524 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 55' ' ' ALA . 45.6 m -55.25 -39.94 70.36 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.079 -1.013 . . . . 0.0 109.566 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.412 HD12 HG22 ' A' ' 60' ' ' ILE . 97.2 mt -64.03 -44.99 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 120.96 -1.088 . . . . 0.0 109.098 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.92 79.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.9 . . . . 0.0 109.737 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.5 m -66.75 -38.29 86.32 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.286 -0.884 . . . . 0.0 109.172 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.8 -43.57 77.0 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.405 -0.809 . . . . 0.0 109.212 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -62.84 -42.17 99.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.105 -0.997 . . . . 0.0 109.532 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.07 -43.44 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.43 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.63 -43.57 98.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.297 -0.877 . . . . 0.0 109.591 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.23 -45.15 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.035 -1.04 . . . . 0.0 109.557 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.83 -41.69 97.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.472 ' O ' ' N ' ' A' ' 73' ' ' ARG . 5.5 t -65.95 -37.91 87.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.289 -0.882 . . . . 0.0 109.425 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.614 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 81.7 t60 -56.39 -45.12 80.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.217 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.13 -38.48 90.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.363 -0.836 . . . . 0.0 109.543 179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -85.89 -73.28 0.46 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.884 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.499 ' O ' ' CB ' ' A' ' 74' ' ' HIS . 33.0 ptt180 -126.59 -140.08 0.27 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.623 -0.673 . . . . 0.0 109.688 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.499 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 13.6 t60 84.78 139.63 0.06 Allowed 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.64 0.733 . . . . 0.0 110.126 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.412 ' O ' ' C ' ' A' ' 76' ' ' GLN . 99.4 m-20 -83.94 111.5 19.31 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.401 -0.812 . . . . 0.0 109.968 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 75' ' ' ASP . 57.8 tt0 36.97 85.21 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.556 0.693 . . . . 0.0 110.933 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.29 -85.5 1.64 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.614 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 42.8 mt -111.01 31.77 5.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.48 -1.011 . . . . 0.0 109.462 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.44 -36.67 84.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.902 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.42 ' OD2' ' O ' ' A' ' 39' ' ' THR . 21.3 p-10 -59.6 -45.84 90.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 109.893 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.52 -41.45 96.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 0.0 110.197 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 CA-C-O 117.87 -1.517 . . . . 0.0 109.574 -179.642 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.8 ttm . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -82.16 142.23 32.39 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.757 0.789 . . . . 0.0 109.991 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.2 m -82.33 134.27 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.849 0.833 . . . . 0.0 109.967 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.43 160.33 14.85 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.67 0.747 . . . . 0.0 110.094 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -108.0 147.17 31.47 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.778 0.799 . . . . 0.0 109.812 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -151.71 119.11 5.99 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.864 0.84 . . . . 0.0 110.051 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.434 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.7 mtp180 45.85 32.09 1.21 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.441 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.22 -23.03 35.33 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -84.03 141.47 31.15 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.516 -0.99 . . . . 0.0 110.317 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -94.3 140.08 30.25 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.742 0.782 . . . . 0.0 109.697 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.406 HD12 HG23 ' A' ' 11' ' ' ILE . 96.8 mt -116.75 128.89 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.678 0.752 . . . . 0.0 109.719 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -123.97 96.49 42.46 Favored Pre-proline 0 N--CA 1.492 1.645 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.13 154.7 37.47 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 122.874 2.383 . . . . 0.0 112.689 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.8 95.75 0.11 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -47.43 146.74 1.93 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.791 -0.829 . . . . 0.0 109.919 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -146.98 157.99 43.79 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.872 0.844 . . . . 0.0 109.799 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -101.34 119.94 39.52 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.733 0.777 . . . . 0.0 109.615 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -95.78 137.86 34.25 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.828 0.823 . . . . 0.0 110.001 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.94 -24.3 41.12 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -62.6 -44.81 95.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.59 -0.693 . . . . 0.0 109.626 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.3 pt -106.98 1.27 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.46 -0.775 . . . . 0.0 109.279 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 42.95 39.59 1.83 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.594 0.711 . . . . 0.0 109.689 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HG3' ' H ' ' A' ' 24' ' ' TYR . 29.4 tptt -145.88 161.46 39.96 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.774 0.797 . . . . 0.0 110.21 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.415 ' H ' ' HG3' ' A' ' 23' ' ' LYS . 95.7 m-85 -85.96 132.7 34.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.916 0.865 . . . . 0.0 109.449 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.6 m -148.1 148.44 29.55 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.796 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.47 110.42 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.745 2.296 . . . . 0.0 111.868 178.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.8 121.44 40.8 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.812 0.815 . . . . 0.0 109.837 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.03 154.11 43.65 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.692 0.758 . . . . 0.0 109.995 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.4 mt -111.4 129.43 56.02 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.695 0.759 . . . . 0.0 109.321 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.426 HD12 HG22 ' A' ' 30' ' ' ILE . 96.7 mt -108.81 130.22 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.712 0.768 . . . . 0.0 109.813 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -130.57 130.83 44.56 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.847 0.832 . . . . 0.0 109.704 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -84.76 135.87 33.94 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.841 0.829 . . . . 0.0 109.837 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 73.1 t -66.89 133.54 31.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.754 0.788 . . . . 0.0 110.124 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.34 -17.63 43.32 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.9 m -154.86 56.74 1.51 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.721 -0.87 . . . . 0.0 109.199 179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.51 -12.39 31.38 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 122.598 2.199 . . . . 0.0 111.033 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.521 ' CG ' ' H ' ' A' ' 38' ' ' ARG . 65.1 t0 -71.83 -124.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.752 -0.592 . . . . 0.0 109.897 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.521 ' H ' ' CG ' ' A' ' 37' ' ' ASP . 18.6 mmm180 44.28 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.661 0.743 . . . . 0.0 110.576 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.9 m -92.03 129.89 40.16 Favored Pre-proline 0 N--CA 1.484 1.255 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 147.32 34.2 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.367 2.045 . . . . 0.0 112.531 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -114.23 126.49 27.93 Favored Pre-proline 0 N--CA 1.487 1.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -74.99 145.54 31.62 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 C-N-CA 122.427 2.085 . . . . 0.0 112.333 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.87 130.73 53.23 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.866 0.841 . . . . 0.0 109.575 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.9 p -141.07 167.42 22.24 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.713 0.768 . . . . 0.0 109.568 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.504 ' O ' ' N ' ' A' ' 47' ' ' GLU . 55.3 t80 -123.88 126.84 25.59 Favored Pre-proline 0 N--CA 1.488 1.448 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -46.28 83.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 122.446 2.097 . . . . 0.0 112.251 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 45' ' ' TYR . 45.2 tp10 -170.79 147.6 2.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 109.374 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -109.88 127.52 54.77 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.607 0.718 . . . . 0.0 109.686 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.05 133.5 54.32 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.979 0.895 . . . . 0.0 109.778 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -87.09 -24.31 24.61 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -103.72 132.53 49.89 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.974 0.892 . . . . 0.0 109.732 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.603 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 1.1 pm0 -68.83 -34.86 76.19 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.39 -47.68 72.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.667 -0.646 . . . . 0.0 109.323 -179.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -65.21 -37.58 87.73 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.575 -0.703 . . . . 0.0 109.371 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.407 ' O ' ' OG ' ' A' ' 59' ' ' SER . . . -66.7 -36.45 82.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.735 -0.603 . . . . 0.0 109.566 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.61 -51.42 67.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.708 -0.62 . . . . 0.0 109.616 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -63.66 -43.47 96.63 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.393 0.616 . . . . 0.0 109.53 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.5 t -64.96 -39.61 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 55' ' ' ALA . 69.3 m -55.89 -43.14 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.578 -0.701 . . . . 0.0 109.519 -179.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.18 -45.88 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.602 -0.686 . . . . 0.0 109.593 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.87 -36.82 80.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.545 -0.722 . . . . 0.0 109.293 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -65.8 -49.44 68.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.647 -0.658 . . . . 0.0 109.732 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.44 -39.77 64.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.736 -0.602 . . . . 0.0 109.661 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -39.82 94.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.71 -0.619 . . . . 0.0 109.688 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.68 -43.97 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.67 -0.644 . . . . 0.0 109.855 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.36 -43.54 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.528 -0.732 . . . . 0.0 109.462 -179.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.2 mt -63.7 -44.71 98.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.434 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 97.2 m-20 -69.99 -44.77 68.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.429 0.633 . . . . 0.0 109.77 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' ARG . 15.1 t -65.7 -42.02 91.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.666 -0.646 . . . . 0.0 109.781 -179.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -59.24 -44.75 92.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.641 -0.662 . . . . 0.0 109.468 -179.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.2 -43.08 96.15 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.645 -0.66 . . . . 0.0 110.025 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -87.3 -71.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.497 -0.752 . . . . 0.0 109.062 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 69' ' ' SER . 89.0 mtm180 -78.59 147.21 33.79 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.71 0.767 . . . . 0.0 110.043 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -55.49 -87.72 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.477 ' O ' ' N ' ' A' ' 77' ' ' GLY . 58.9 t0 44.02 70.52 0.31 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.442 0.639 . . . . 0.0 109.514 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -43.66 95.27 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.72 0.771 . . . . 0.0 109.817 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 75' ' ' ASP . . . -118.75 -60.75 0.28 Allowed Glycine 0 N--CA 1.494 2.521 0 N-CA-C 108.934 -1.667 . . . . 0.0 108.934 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.5 mt -100.35 21.34 13.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.581 -0.952 . . . . 0.0 108.456 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.34 98.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.931 -0.48 . . . . 0.0 109.944 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.86 -35.83 81.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.682 -0.636 . . . . 0.0 109.547 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.2 mt -85.1 -6.26 59.31 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 109.5 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.675 0 CA-C-O 117.952 -1.471 . . . . 0.0 109.729 -179.774 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.4 ttp . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -73.96 140.33 45.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.51 -0.743 . . . . 0.0 109.777 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.4 m -87.8 155.18 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.447 -0.783 . . . . 0.0 109.754 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.86 133.28 53.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.563 -0.711 . . . . 0.0 109.525 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -83.34 135.17 34.82 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.413 -0.804 . . . . 0.0 109.971 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -144.0 117.86 9.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.347 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.411 ' HE ' ' CD1' ' A' ' 71' ' ' LEU . 78.5 mtp85 53.85 29.15 9.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.551 -0.718 . . . . 0.0 109.758 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.09 -4.56 83.04 Favored Glycine 0 N--CA 1.494 2.531 0 N-CA-C 110.199 -1.161 . . . . 0.0 110.199 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -105.89 134.44 49.02 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.456 -1.026 . . . . 0.0 109.935 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.89 144.6 25.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 109.091 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 78.8 mt -120.19 136.45 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.249 0.547 . . . . 0.0 109.628 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -121.56 85.61 43.71 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -61.48 150.22 86.17 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.858 2.372 . . . . 0.0 112.536 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.566 ' O ' ' CG ' ' A' ' 15' ' ' HIS . . . -174.01 -9.1 0.02 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.566 ' CG ' ' O ' ' A' ' 14' ' ' GLY . 3.9 p-80 56.57 153.34 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.785 -0.832 . . . . 0.0 110.571 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -169.24 153.11 5.23 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.494 -0.754 . . . . 0.0 109.059 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -98.99 137.49 37.45 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.537 -0.727 . . . . 0.0 109.649 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -92.19 135.95 33.58 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.582 -0.699 . . . . 0.0 109.593 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.47 -19.95 63.75 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.51 -0.744 . . . . 0.0 109.504 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -62.95 -44.65 95.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.477 -0.765 . . . . 0.0 109.88 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.2 pt -109.71 2.76 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.666 -0.646 . . . . 0.0 109.289 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 43.44 43.05 4.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.626 -0.672 . . . . 0.0 109.438 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.8 tptm -139.39 164.46 29.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.409 -0.807 . . . . 0.0 109.732 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -85.1 129.97 34.7 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.734 -0.604 . . . . 0.0 109.765 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -150.17 155.17 37.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.378 -0.826 . . . . 0.0 108.998 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -43.47 135.83 6.41 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.198 1.932 . . . . 0.0 112.693 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE2' ' CB ' ' A' ' 42' ' ' PRO . 48.7 t80 -153.5 114.47 4.1 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.39 152.35 49.55 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.388 -0.82 . . . . 0.0 109.706 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.05 129.62 44.89 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.431 HG22 HD12 ' A' ' 30' ' ' ILE . 97.4 mt -115.83 131.41 68.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.627 -0.671 . . . . 0.0 110.035 -179.041 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -132.9 145.74 51.19 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.586 -0.696 . . . . 0.0 109.21 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -82.62 128.23 34.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.211 -0.93 . . . . 0.0 109.797 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.4 t -74.54 133.8 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.566 -0.709 . . . . 0.0 110.165 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 115.42 -51.42 0.72 Allowed Glycine 0 N--CA 1.494 2.548 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 36' ' ' PRO . 9.1 m -99.83 151.79 37.6 Favored Pre-proline 0 N--CA 1.497 1.904 0 O-C-N 121.311 -1.111 . . . . 0.0 110.138 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.448 ' O ' ' O ' ' A' ' 35' ' ' VAL . 74.9 Cg_exo -47.36 -170.99 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.715 2.277 . . . . 0.0 113.031 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 37' ' ' ASP . 45.1 p-10 -98.25 108.13 20.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.579 -0.701 . . . . 0.0 109.649 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.549 HH21 ' C ' ' A' ' 81' ' ' LEU . 96.4 mtm-85 -98.44 -173.5 2.57 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.248 -0.908 . . . . 0.0 110.25 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.423 ' C ' ' O ' ' A' ' 38' ' ' ARG . 45.9 m -40.15 105.77 0.38 Allowed Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.918 -0.489 . . . . 0.0 109.825 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -75.45 146.86 31.58 Favored 'Trans proline' 0 N--CA 1.493 1.499 0 C-N-CA 122.197 1.932 . . . . 0.0 113.024 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -134.35 90.69 24.21 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.479 ' CB ' ' CE2' ' A' ' 27' ' ' TYR . 48.3 Cg_exo -54.72 144.75 63.7 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.319 2.013 . . . . 0.0 111.87 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 t -99.67 136.14 40.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.581 -0.699 . . . . 0.0 109.227 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -136.56 157.52 46.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -139.31 101.35 7.54 Favored Pre-proline 0 N--CA 1.492 1.64 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.2 107.14 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 121.825 1.683 . . . . 0.0 112.475 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 48' ' ' PHE . 54.6 mt-10 -150.66 -13.13 0.24 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.436 ' O ' ' O ' ' A' ' 47' ' ' GLU . 1.6 m-85 54.24 108.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.238 0.542 . . . . 0.0 110.1 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -131.54 132.86 44.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.582 -0.699 . . . . 0.0 109.417 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -87.24 -22.11 25.41 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.736 . . . . 0.0 109.316 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -91.12 133.08 35.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.466 -0.771 . . . . 0.0 110.659 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -67.62 -38.02 83.33 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.55 -40.45 91.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 109.759 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.75 -43.3 99.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.433 -0.792 . . . . 0.0 109.817 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.48 96.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.453 -0.78 . . . . 0.0 110.034 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -66.91 -49.44 65.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.401 -0.812 . . . . 0.0 109.911 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -65.99 -43.65 87.18 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.514 -0.741 . . . . 0.0 109.653 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.11 -42.65 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.603 -0.686 . . . . 0.0 109.532 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -58.09 -42.23 85.18 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.458 -0.777 . . . . 0.0 109.87 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.4 mt -64.81 -44.85 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.139 -0.975 . . . . 0.0 109.372 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.06 -44.36 80.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.502 -0.749 . . . . 0.0 109.485 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.1 m -65.86 -43.62 87.83 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.583 -0.698 . . . . 0.0 109.265 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -50.17 -42.91 51.96 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -63.31 -43.01 99.03 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.489 -0.757 . . . . 0.0 109.302 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.429 HG22 HD13 ' A' ' 65' ' ' ILE . 94.6 mt -64.12 -44.75 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.375 -0.828 . . . . 0.0 109.774 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -66.04 -45.93 89.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.376 -0.828 . . . . 0.0 109.138 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.8 mt -64.75 -44.65 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.485 -0.759 . . . . 0.0 109.629 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -68.52 -46.35 69.8 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.538 -0.727 . . . . 0.0 109.87 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.6 m -62.63 -42.15 99.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.568 -0.708 . . . . 0.0 110.094 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.402 ' O ' ' O ' ' A' ' 73' ' ' ARG . 76.3 t60 -59.16 -42.34 90.51 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.754 . . . . 0.0 109.674 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.411 ' CD1' ' HE ' ' A' ' 7' ' ' ARG . 81.9 mt -64.88 -36.0 82.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.588 -0.695 . . . . 0.0 109.719 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -64.93 -16.59 63.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.854 . . . . 0.0 109.626 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.402 ' O ' ' O ' ' A' ' 70' ' ' HIS . 17.3 ptm180 -151.44 -145.21 0.17 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.275 -0.891 . . . . 0.0 109.223 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.468 ' CD2' ' O ' ' A' ' 74' ' ' HIS . 53.2 p-80 -141.07 43.77 1.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -0.873 . . . . 0.0 108.908 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.527 ' O ' ' N ' ' A' ' 77' ' ' GLY . 53.5 t0 -63.3 123.52 18.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.414 -0.804 . . . . 0.0 109.157 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -42.68 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.62 -0.675 . . . . 0.0 109.841 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 75' ' ' ASP . . . -152.96 -83.01 0.04 OUTLIER Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.6 mt -101.91 17.87 22.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.536 -0.979 . . . . 0.0 109.521 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.93 -38.68 89.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.393 -0.817 . . . . 0.0 109.48 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.85 -37.28 86.79 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.524 -0.735 . . . . 0.0 109.835 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.549 ' C ' HH21 ' A' ' 38' ' ' ARG . 54.2 mt -83.38 -3.14 57.24 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.354 -0.841 . . . . 0.0 109.121 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.76 140.62 32.68 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.267 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -83.19 149.85 26.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.0 110.267 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.406 ' N ' ' O ' ' A' ' 9' ' ' TYR . 88.1 t80 -153.54 115.04 4.2 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.409 -0.807 . . . . 0.0 109.327 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.488 HH12 ' CD1' ' A' ' 71' ' ' LEU . 20.7 mtp-105 52.07 30.18 7.22 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 109.921 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.68 -1.87 81.82 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.406 ' O ' ' N ' ' A' ' 6' ' ' TYR . 95.4 m-85 -106.73 141.93 37.19 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.373 -1.075 . . . . 0.0 109.761 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -89.72 146.1 24.74 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.524 -0.735 . . . . 0.0 109.491 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -121.59 136.52 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' ' H ' ' A' ' 29' ' ' LEU . 21.7 tt0 -119.18 87.68 35.46 Favored Pre-proline 0 N--CA 1.496 1.857 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.11 146.05 95.68 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.524 2.149 . . . . 0.0 112.204 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.54 -167.72 39.37 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -148.48 142.9 26.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.283 -1.127 . . . . 0.0 109.535 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -161.85 150.57 15.48 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -109.09 143.5 38.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.476 -0.765 . . . . 0.0 109.66 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.438 ' NH2' HG21 ' A' ' 44' ' ' THR . 86.2 mtt180 -99.47 139.11 35.61 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 121.529 0.68 . . . . 0.0 109.83 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.26 -20.24 64.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.442 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.92 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.154 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.5 pt -109.63 0.02 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 42.12 39.64 1.44 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.785 -0.572 . . . . 0.0 109.868 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -140.5 161.45 37.7 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.285 -0.885 . . . . 0.0 109.825 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -85.73 130.86 34.45 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.429 0.633 . . . . 0.0 109.854 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.98 146.85 32.58 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.45 -0.781 . . . . 0.0 109.338 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -37.72 111.55 0.1 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 122.571 2.181 . . . . 0.0 112.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -121.57 117.33 26.5 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -142.15 159.0 43.11 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.193 -0.942 . . . . 0.0 109.592 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.431 ' H ' ' HB3' ' A' ' 12' ' ' GLU . 53.8 mt -113.6 134.47 54.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.638 -0.664 . . . . 0.0 109.238 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.9 mt -111.92 133.1 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.681 -0.637 . . . . 0.0 109.53 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -127.32 130.63 49.84 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -83.4 138.64 33.41 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.646 0.736 . . . . 0.0 110.326 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.5 t . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.718 -0.614 . . . . 0.0 109.939 -179.777 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.25 151.92 44.11 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.887 1.725 . . . . 0.0 111.882 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.489 HD11 ' OD2' ' A' ' 80' ' ' ASP . 38.6 mm -115.48 100.21 53.33 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.57 136.2 41.13 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 121.897 1.731 . . . . 0.0 112.483 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 p -95.27 134.97 37.45 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.438 HG21 ' NH2' ' A' ' 18' ' ' ARG . 54.7 p -138.01 167.16 22.36 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -148.89 141.68 15.42 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.178 -0.951 . . . . 0.0 108.929 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.56 86.33 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.88 1.72 . . . . 0.0 112.226 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -176.4 169.5 2.66 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.499 -0.751 . . . . 0.0 108.98 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -130.7 146.91 52.3 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.418 -0.801 . . . . 0.0 109.413 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.505 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 27.9 m-85 -141.81 123.46 15.1 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.356 -0.84 . . . . 0.0 109.589 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.16 -33.25 67.57 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.355 0.598 . . . . 0.0 109.701 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -89.45 133.12 34.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.805 . . . . 0.0 110.538 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -69.57 -36.04 75.91 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.452 0.644 . . . . 0.0 109.476 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.58 91.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.506 -0.746 . . . . 0.0 109.515 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.505 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 58.0 t0 -63.09 -38.01 89.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.378 -0.826 . . . . 0.0 109.051 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.41 -36.64 84.81 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.493 -0.754 . . . . 0.0 109.639 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.53 -49.48 75.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 109.731 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.63 -42.77 95.27 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.272 -0.892 . . . . 0.0 109.444 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.5 t -65.22 -42.78 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.564 -0.71 . . . . 0.0 109.631 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 98.1 p -56.62 -39.39 73.55 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.411 -0.805 . . . . 0.0 109.676 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.84 -45.29 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 109.296 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.71 82.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.339 -0.851 . . . . 0.0 109.423 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.56 -46.15 76.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.468 -0.77 . . . . 0.0 109.5 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.13 73.99 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.369 -0.832 . . . . 0.0 109.452 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.42 -43.96 95.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.301 -0.874 . . . . 0.0 109.365 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.37 -44.38 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.433 -0.792 . . . . 0.0 110.104 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 32.7 mm -64.17 -44.38 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.157 -0.964 . . . . 0.0 109.404 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 94.7 mt -64.38 -45.66 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.159 -0.963 . . . . 0.0 109.506 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.28 -46.36 77.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.338 -0.852 . . . . 0.0 109.635 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.2 m -63.15 -37.91 89.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.546 -0.721 . . . . 0.0 109.85 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -59.78 -47.9 83.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.631 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.488 ' CD1' HH12 ' A' ' 7' ' ' ARG . 90.6 mt -64.18 -42.8 96.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.348 -0.845 . . . . 0.0 109.871 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 . . . . . 0 N--CA 1.493 1.721 0 O-C-N 121.319 -0.863 . . . . 0.0 110.33 -179.493 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.18 30.55 1.23 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.275 -1.133 . . . . 0.0 109.305 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.15 -35.81 81.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.648 -0.658 . . . . 0.0 109.308 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.489 ' OD2' HD11 ' A' ' 41' ' ' ILE . 23.1 p-10 -64.69 -31.88 73.3 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.481 -0.762 . . . . 0.0 109.625 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.35 -3.29 57.36 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.326 -0.859 . . . . 0.0 109.471 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.68 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.173 0.511 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.28 140.82 47.67 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.575 -0.703 . . . . 0.0 109.433 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.9 m170 -85.13 154.13 22.23 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.401 -0.812 . . . . 0.0 110.307 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.615 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 20.6 t80 -153.3 111.43 3.62 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.328 -0.857 . . . . 0.0 109.044 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.615 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 47.41 31.86 2.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.539 -0.726 . . . . 0.0 110.102 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.34 -20.74 47.98 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -85.4 138.42 32.27 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -1.067 . . . . 0.0 110.107 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.31 139.13 31.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.626 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.0 mt -121.29 130.42 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -121.93 87.94 47.31 Favored Pre-proline 0 N--CA 1.496 1.837 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -57.82 144.97 92.56 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 122.697 2.264 . . . . 0.0 112.506 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.91 98.19 0.11 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -49.01 155.82 0.58 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.434 -1.039 . . . . 0.0 110.793 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -154.87 157.87 38.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.39 -0.819 . . . . 0.0 109.051 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -99.96 120.66 40.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.593 -0.692 . . . . 0.0 109.396 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.483 ' NH1' ' OG1' ' A' ' 44' ' ' THR . 84.4 mtp180 -102.04 138.58 38.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.601 -0.687 . . . . 0.0 109.964 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.22 -17.03 58.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.554 -0.716 . . . . 0.0 109.404 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -59.64 -49.54 77.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.222 -0.924 . . . . 0.0 109.652 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.444 HG13 ' H ' ' A' ' 23' ' ' LYS . 41.1 pt -107.9 0.27 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 50.33 34.93 9.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.643 -0.661 . . . . 0.0 109.582 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.444 ' H ' HG13 ' A' ' 21' ' ' ILE . 56.0 mmtt -140.44 174.42 10.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.366 -0.834 . . . . 0.0 110.217 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -93.72 130.29 39.74 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.534 0.683 . . . . 0.0 109.954 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' O ' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -143.17 155.63 61.68 Favored Pre-proline 0 N--CA 1.492 1.632 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -55.37 110.19 0.52 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.211 1.941 . . . . 0.0 111.85 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -114.68 117.54 31.12 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -132.52 147.94 52.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.581 -0.699 . . . . 0.0 109.534 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -93.3 128.33 39.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.539 -0.726 . . . . 0.0 109.474 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.3 mt -110.01 127.5 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -132.0 133.27 44.26 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.582 -0.699 . . . . 0.0 109.395 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.42 125.6 40.15 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.661 0.744 . . . . 0.0 109.562 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.7 t . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.533 0.682 . . . . 0.0 110.694 -179.338 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.34 153.95 70.11 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.006 1.804 . . . . 0.0 112.272 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.6 mm -122.34 88.87 49.07 Favored Pre-proline 0 N--CA 1.494 1.732 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -55.25 146.6 59.81 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.662 2.241 . . . . 0.0 112.539 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.78 135.79 40.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.569 -0.707 . . . . 0.0 109.587 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.483 ' OG1' ' NH1' ' A' ' 18' ' ' ARG . 32.0 p -136.21 167.93 20.36 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -136.2 136.62 22.94 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.99 86.82 1.06 Allowed 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 121.974 1.783 . . . . 0.0 112.119 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.472 ' O ' ' CG1' ' A' ' 25' ' ' VAL . 8.9 tt0 -168.54 -173.35 1.9 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 109.213 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -133.69 121.17 21.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.609 -0.682 . . . . 0.0 109.26 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.508 ' C ' ' H ' ' A' ' 51' ' ' LEU . 91.8 m-85 -111.79 -36.88 5.31 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.9 t0 58.87 -0.3 0.14 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.775 -0.578 . . . . 0.0 109.925 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.8 mt -118.03 126.67 52.75 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.397 -0.815 . . . . 0.0 109.638 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.95 -42.49 80.85 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.591 -0.693 . . . . 0.0 109.641 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.66 -47.93 83.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.621 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 58' ' ' VAL . 38.7 t0 -67.0 -38.76 86.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.75 -40.98 98.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.304 -0.873 . . . . 0.0 109.216 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.87 -44.99 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.874 . . . . 0.0 109.649 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -65.63 -44.57 86.05 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.282 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 54' ' ' ASP . 72.0 t -67.87 -41.4 84.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.572 -0.705 . . . . 0.0 109.418 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.4 p -56.63 -41.32 76.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.207 -0.933 . . . . 0.0 109.616 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.34 -45.0 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.055 -1.028 . . . . 0.0 109.509 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.69 -46.04 73.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.375 -0.828 . . . . 0.0 109.96 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.5 m -66.24 -49.58 66.72 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.423 -0.798 . . . . 0.0 109.495 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -45.4 -46.14 13.1 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.679 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.59 -41.87 98.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.02 -43.93 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.152 -0.968 . . . . 0.0 109.466 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.64 -44.81 96.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -0.928 . . . . 0.0 108.621 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.07 -43.94 97.62 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 O-C-N 121.06 -1.025 . . . . 0.0 108.795 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.93 -41.82 97.53 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.317 -0.864 . . . . 0.0 109.19 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -60.91 -40.91 94.89 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.525 -0.734 . . . . 0.0 109.35 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -58.92 -44.84 91.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.194 -0.941 . . . . 0.0 109.157 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.14 -41.12 97.31 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.494 -0.754 . . . . 0.0 109.045 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 . . . . . 0 C--N 1.304 -1.406 0 O-C-N 121.405 -0.809 . . . . 0.0 109.432 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.61 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -85.26 33.05 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -1.151 . . . . 0.0 108.414 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.624 -0.672 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.9 -45.57 91.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.366 -0.834 . . . . 0.0 109.618 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.54 -41.39 93.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.337 -0.852 . . . . 0.0 109.773 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.021 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 -179.486 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 121.181 0.515 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.61 138.84 51.12 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.72 -0.612 . . . . 0.0 109.594 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -99.6 114.81 28.07 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.393 -0.817 . . . . 0.0 109.531 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -86.72 -75.62 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.432 -0.792 . . . . 0.0 109.66 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -127.2 52.14 1.83 Allowed 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 93.96 -0.41 66.92 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -112.39 140.32 47.22 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.385 -1.068 . . . . 0.0 109.993 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -84.21 145.13 28.51 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -120.94 130.2 74.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -127.3 97.75 30.88 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.93 153.79 37.73 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.422 2.082 . . . . 0.0 113.201 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.71 -150.14 8.09 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.52 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 52.7 p-80 -152.67 147.53 26.22 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -1.111 . . . . 0.0 109.428 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.427 ' OE1' ' CZ ' ' A' ' 27' ' ' TYR . 58.4 tt0 -169.05 157.67 8.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.392 -0.818 . . . . 0.0 109.02 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -110.04 145.77 36.47 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.464 0.65 . . . . 0.0 110.002 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.559 HH21 ' CG2' ' A' ' 44' ' ' THR . 35.2 mmt180 -96.32 125.24 40.69 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.658 0.742 . . . . 0.0 109.728 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 38.5 p-10 -70.22 -21.5 63.01 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.715 -0.615 . . . . 0.0 109.959 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -62.33 -42.58 99.49 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.764 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.6 pt -116.7 -6.8 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' ARG . 28.0 mmt180 55.82 57.55 5.11 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.4 0.619 . . . . 0.0 110.034 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -144.09 160.17 41.36 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 0.0 109.788 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -90.23 129.28 36.5 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.628 -0.67 . . . . 0.0 109.375 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 11.8 m -141.93 148.97 51.15 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.447 -0.783 . . . . 0.0 109.544 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -41.48 110.1 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.294 0 C-N-CA 122.307 2.004 . . . . 0.0 111.536 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.427 ' CZ ' ' OE1' ' A' ' 16' ' ' GLN . 56.2 t80 -103.66 116.74 32.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.804 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -139.77 144.29 37.35 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.1 mt -109.96 130.45 55.53 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.8 mt -112.71 131.04 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -129.04 132.3 47.46 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -83.89 138.78 33.01 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.427 -0.796 . . . . 0.0 109.619 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.7 t . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.407 -0.808 . . . . 0.0 110.36 -179.44 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.484 1.226 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.28 140.75 45.28 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.141 1.894 . . . . 0.0 112.582 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.93 103.27 54.85 Favored Pre-proline 0 N--CA 1.494 1.735 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.18 145.1 38.51 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.095 1.863 . . . . 0.0 112.061 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.804 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -108.64 137.49 46.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.548 -0.72 . . . . 0.0 109.457 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.559 ' CG2' HH21 ' A' ' 18' ' ' ARG . 45.8 p -138.09 167.85 20.95 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -130.99 140.39 38.53 Favored Pre-proline 0 N--CA 1.491 1.589 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -43.33 -28.25 1.49 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 122.207 1.938 . . . . 0.0 112.089 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.51 158.79 26.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.317 -0.864 . . . . 0.0 110.158 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -126.8 147.75 49.99 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.637 -0.665 . . . . 0.0 109.389 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.516 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 78.9 m-85 -152.44 114.52 4.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.326 -0.859 . . . . 0.0 109.801 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -71.13 -33.49 70.15 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.529 -0.732 . . . . 0.0 109.207 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -69.74 135.34 49.65 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.528 -0.733 . . . . 0.0 110.332 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.52 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 85.1 tt0 -71.74 -41.05 68.96 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.503 -0.748 . . . . 0.0 109.731 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.21 -45.94 86.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -0.874 . . . . 0.0 109.738 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.516 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.0 t0 -63.99 -38.58 91.6 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.346 -0.846 . . . . 0.0 109.546 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.64 91.83 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.47 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.81 -46.39 82.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.345 -0.847 . . . . 0.0 109.724 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -64.21 -44.38 92.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.325 -0.859 . . . . 0.0 109.621 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.3 t -67.32 -42.03 87.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.393 -0.817 . . . . 0.0 109.761 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.558 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 78.5 p -56.49 -40.75 75.47 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.688 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.441 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 96.6 mt -64.13 -45.66 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.983 -1.073 . . . . 0.0 109.155 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.09 -38.8 86.34 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.6 t -64.95 -50.55 65.98 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.537 -0.727 . . . . 0.0 109.437 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.66 -41.71 43.44 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.62 -0.675 . . . . 0.0 109.634 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.441 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 63.2 mttp -62.9 -41.35 99.41 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.293 -0.879 . . . . 0.0 109.337 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.5 mt -64.1 -43.84 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.839 . . . . 0.0 109.805 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 66' ' ' ILE . 2.0 mp -65.54 -45.33 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.0 109.129 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.62 -44.84 96.71 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.163 -0.961 . . . . 0.0 109.371 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -67.59 -43.78 79.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.333 -0.854 . . . . 0.0 109.719 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.402 ' HG ' ' HA ' ' A' ' 66' ' ' ILE . 78.0 p -67.04 -35.59 80.21 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.385 -0.822 . . . . 0.0 109.067 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.38 -43.99 92.81 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.285 -0.884 . . . . 0.0 109.394 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.9 mt -63.75 -40.99 98.06 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.377 -0.827 . . . . 0.0 109.218 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.438 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 57.3 t0 . . . . . 0 C--N 1.303 -1.454 0 O-C-N 121.351 -0.843 . . . . 0.0 109.198 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.409 ' C ' ' O ' ' A' ' 77' ' ' GLY . 9.1 mt 41.68 22.99 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.52 -0.988 . . . . 0.0 109.586 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' A' ' 77' ' ' GLY . . . -60.21 -47.71 84.81 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.55 -0.719 . . . . 0.0 109.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -65.68 -36.54 83.93 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.339 -0.85 . . . . 0.0 109.451 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.9 mt -84.09 -3.19 57.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.388 -0.82 . . . . 0.0 109.255 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 179.984 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.439 0.637 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -89.36 159.99 17.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.453 -0.779 . . . . 0.0 109.815 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.91 139.88 47.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.553 -0.717 . . . . 0.0 109.392 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -151.05 119.98 6.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.189 -0.945 . . . . 0.0 109.496 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 54.28 28.04 8.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.648 -0.658 . . . . 0.0 110.199 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 0.21 86.34 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -104.35 139.99 38.53 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.578 -0.954 . . . . 0.0 109.504 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.2 140.74 29.16 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.406 -0.809 . . . . 0.0 109.144 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -119.83 130.13 74.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -117.11 121.04 32.96 Favored Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.02 157.68 46.6 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.059 1.839 . . . . 0.0 112.565 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.05 -172.27 44.3 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.7 p80 -150.7 146.06 26.21 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.339 -1.095 . . . . 0.0 109.073 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.51 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 53.8 tt0 -168.47 155.62 7.66 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.276 -0.89 . . . . 0.0 109.002 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -104.91 139.9 38.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.494 -0.754 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.2 mtp180 -90.97 134.43 34.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.559 -0.713 . . . . 0.0 109.566 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 39.0 p-10 -68.29 -21.49 64.78 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.368 -0.833 . . . . 0.0 109.247 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -60.9 -47.68 85.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.554 -0.716 . . . . 0.0 109.867 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 18.6 pt -107.39 -2.5 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.473 -0.767 . . . . 0.0 108.99 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 49.21 46.64 22.77 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.504 -0.747 . . . . 0.0 110.051 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.25 165.9 26.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -0.821 . . . . 0.0 109.598 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -85.04 132.78 34.28 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.541 -0.725 . . . . 0.0 109.766 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.77 156.03 41.26 Favored Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.285 -0.884 . . . . 0.0 108.794 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -43.85 128.94 7.26 Favored 'Trans proline' 0 C--N 1.314 -1.273 0 C-N-CA 122.11 1.873 . . . . 0.0 112.067 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.51 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 66.0 t80 -131.85 120.38 22.5 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 59' ' ' SER . . . -144.53 151.71 39.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.168 -0.958 . . . . 0.0 108.789 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.2 mt -106.11 129.93 54.1 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.6 mt -110.68 130.44 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.638 -0.664 . . . . 0.0 109.32 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -131.24 126.66 36.06 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -81.49 139.24 35.28 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.339 -0.851 . . . . 0.0 109.741 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 69.9 t . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 110.246 -179.546 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.487 1.382 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -73.01 152.58 51.63 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 122.339 2.026 . . . . 0.0 112.512 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.6 mm -129.0 89.3 49.1 Favored Pre-proline 0 N--CA 1.499 1.987 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -56.1 145.75 73.87 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.317 2.011 . . . . 0.0 111.547 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -117.1 135.4 53.77 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.556 0.693 . . . . 0.0 109.821 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.0 p -138.03 166.2 24.68 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -133.01 133.89 23.74 Favored Pre-proline 0 N--CA 1.495 1.798 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.82 85.14 1.36 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.957 1.772 . . . . 0.0 112.329 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.443 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 80.7 tt0 -138.62 -16.18 1.17 Allowed 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 47' ' ' GLU . 9.6 m-85 58.39 119.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.131 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.533 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 12.4 m-85 -131.37 133.97 45.82 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.736 0.779 . . . . 0.0 109.419 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -85.06 -24.76 27.99 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.706 -0.621 . . . . 0.0 109.456 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.4 mm? -96.91 126.17 41.87 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 122.079 0.943 . . . . 0.0 109.854 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -67.76 -33.36 74.68 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.53 -47.32 86.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.609 -0.682 . . . . 0.0 110.016 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 14.9 t70 -64.35 -34.39 78.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.513 -0.742 . . . . 0.0 109.342 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.2 -42.3 90.58 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.564 -0.71 . . . . 0.0 109.538 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -64.13 -49.3 72.72 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.449 -0.782 . . . . 0.0 109.845 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -63.59 -43.93 95.5 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.488 -0.758 . . . . 0.0 109.418 -179.516 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.3 t -64.17 -42.27 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.374 -0.829 . . . . 0.0 109.286 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.539 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 31.2 m -52.39 -42.95 64.44 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.272 -0.892 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.02 -44.77 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.279 -0.888 . . . . 0.0 109.265 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.89 71.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.438 -0.789 . . . . 0.0 109.698 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.93 -43.29 99.16 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.484 -0.76 . . . . 0.0 109.147 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.34 -42.44 41.74 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.403 -0.811 . . . . 0.0 109.285 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -62.58 -43.67 98.23 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.38 -0.825 . . . . 0.0 109.251 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -65.82 -45.19 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.502 -0.749 . . . . 0.0 109.791 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.3 -44.47 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 0.0 109.165 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.03 -45.02 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.134 -0.979 . . . . 0.0 109.112 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -65.13 -44.26 89.23 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.468 -0.77 . . . . 0.0 109.606 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.4 m -63.76 -36.64 84.55 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.583 -0.698 . . . . 0.0 109.641 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 13.6 t60 -57.8 -50.62 72.66 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.1 mt -66.5 -42.01 88.03 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.48 -0.762 . . . . 0.0 110.171 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.36 -0.838 . . . . 0.0 110.279 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.451 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.4 mt 55.1 20.44 3.31 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.491 -1.005 . . . . 0.0 109.388 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.92 89.17 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.416 -0.802 . . . . 0.0 109.677 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.01 -37.45 87.25 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.362 -0.836 . . . . 0.0 109.475 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 44.1 mt -82.48 -3.8 56.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.383 -0.823 . . . . 0.0 109.428 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.481 ' CG1' ' OE1' ' A' ' 12' ' ' GLU . 15.3 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.636 0.731 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.73 153.02 19.18 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.501 -0.749 . . . . 0.0 109.622 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -103.65 128.65 50.93 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.574 -0.704 . . . . 0.0 109.771 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -143.03 121.89 12.7 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.403 -0.811 . . . . 0.0 109.574 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 54.14 24.73 5.06 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.534 0.683 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.62 4.09 80.16 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -109.53 139.5 44.46 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.532 -0.981 . . . . 0.0 109.975 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -87.28 144.93 26.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.391 -0.818 . . . . 0.0 109.577 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -123.47 131.79 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.667 -0.645 . . . . 0.0 109.417 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.481 ' OE1' ' CG1' ' A' ' 3' ' ' VAL . 8.8 tp10 -116.0 117.63 39.19 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.19 155.0 32.96 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.187 1.925 . . . . 0.0 112.845 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.99 -163.76 36.2 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -151.27 146.46 26.06 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.026 -1.279 . . . . 0.0 109.346 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.48 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 49.2 tt0 -166.23 155.31 11.34 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.165 -0.959 . . . . 0.0 109.755 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -107.24 135.51 48.64 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.316 0.579 . . . . 0.0 109.849 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.491 ' O ' ' N ' ' A' ' 22' ' ' ARG . 79.9 mtp85 -96.08 137.97 34.38 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.83 0.824 . . . . 0.0 109.981 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -67.31 -21.98 65.65 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.524 0.678 . . . . 0.0 109.306 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.61 -44.52 96.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.449 -0.782 . . . . 0.0 109.906 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.1 pt -114.68 0.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.491 ' N ' ' O ' ' A' ' 18' ' ' ARG . 84.5 mtt85 43.56 41.08 3.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.546 -0.721 . . . . 0.0 110.235 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -136.69 159.83 40.65 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.414 -0.804 . . . . 0.0 109.793 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -87.18 119.23 27.2 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.453 0.644 . . . . 0.0 109.735 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.6 m -130.93 152.83 81.32 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -41.74 114.11 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.722 1.615 . . . . 0.0 111.282 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.48 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 64.7 t80 -111.47 121.32 44.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.595 -0.691 . . . . 0.0 109.644 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 59' ' ' SER . . . -143.56 154.98 44.15 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.326 -0.859 . . . . 0.0 108.985 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.0 mt -112.31 132.46 54.95 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -113.09 131.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.4 ttm-85 -132.67 136.69 46.61 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.605 -0.685 . . . . 0.0 109.689 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -80.19 134.29 36.12 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.689 0.757 . . . . 0.0 109.735 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t . . . . . 0 N--CA 1.488 1.468 0 O-C-N 121.479 -0.763 . . . . 0.0 110.501 -179.25 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.2 m . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.95 154.13 37.89 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.169 1.913 . . . . 0.0 112.682 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.497 ' N ' HD12 ' A' ' 41' ' ' ILE . 4.3 mp -121.99 130.12 24.86 Favored Pre-proline 0 N--CA 1.494 1.738 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.4 148.93 55.68 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.125 1.883 . . . . 0.0 112.488 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.542 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -119.98 129.99 54.55 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.68 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.3 p -140.05 167.41 22.2 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 47' ' ' GLU . 9.2 t80 -135.58 136.53 24.02 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.637 -0.664 . . . . 0.0 109.626 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -45.38 81.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.373 2.049 . . . . 0.0 112.183 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 45' ' ' TYR . 6.3 pt-20 178.08 133.8 0.07 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -116.61 163.17 16.5 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.725 0.774 . . . . 0.0 109.491 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.512 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 90.0 m-85 -145.15 -35.24 0.32 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.583 -0.698 . . . . 0.0 109.257 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 49' ' ' TYR . 5.4 t0 79.84 -18.12 0.53 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 51' ' ' LEU . 3.6 mm? -98.98 126.36 44.66 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 122.185 0.993 . . . . 0.0 110.153 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -32.25 73.7 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.548 ' HB1' HH12 ' A' ' 57' ' ' ARG . . . -61.88 -51.79 66.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.307 -0.871 . . . . 0.0 109.914 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.512 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 39.2 t0 -72.14 -36.76 69.45 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.711 0.767 . . . . 0.0 109.486 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.08 -47.37 85.49 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.424 -0.798 . . . . 0.0 109.922 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.42 -45.1 89.01 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.548 HH12 ' HB1' ' A' ' 53' ' ' ALA . 84.8 mtt85 -63.87 -45.09 91.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.127 -0.983 . . . . 0.0 109.924 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -67.56 -42.34 86.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.333 -0.854 . . . . 0.0 109.093 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.575 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 99.9 p -55.76 -40.61 72.84 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.446 -0.784 . . . . 0.0 109.668 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.1 mt -64.94 -45.01 96.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.95 -1.094 . . . . 0.0 109.646 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.44 -42.26 79.11 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.048 -1.033 . . . . 0.0 109.549 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 90.6 m -68.55 -39.16 81.19 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.459 -0.776 . . . . 0.0 109.476 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -46.79 71.34 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.238 -0.914 . . . . 0.0 109.064 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -63.17 -41.73 99.28 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.39 -42.79 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.823 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.2 mm -63.69 -43.24 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.04 -1.037 . . . . 0.0 109.191 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 91.8 mt -62.88 -47.71 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 120.993 -1.067 . . . . 0.0 109.377 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -66.14 -44.12 85.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.381 -0.824 . . . . 0.0 109.698 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.8 t -63.23 -41.43 99.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.487 -0.758 . . . . 0.0 109.315 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.504 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 73.5 t60 -58.77 -39.08 79.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.423 -0.798 . . . . 0.0 109.634 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.4 -42.54 98.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.223 -0.923 . . . . 0.0 110.112 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.234 -0.917 . . . . 0.0 110.192 -179.466 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.535 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.493 2.444 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.8 mt 63.04 -9.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 122.004 -0.704 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.535 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.9 -34.17 77.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.003 -1.06 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.466 ' HB2' HD11 ' A' ' 41' ' ' ILE . 99.2 m-20 -65.01 -13.95 59.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.428 -0.795 . . . . 0.0 109.474 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.99 -5.17 59.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.22 -0.925 . . . . 0.0 109.003 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.79 -1.561 . . . . 0.0 109.321 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.128 0.489 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.22 135.44 54.68 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.637 -0.664 . . . . 0.0 109.28 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -84.6 146.7 27.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.429 -0.794 . . . . 0.0 110.373 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -154.6 119.16 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.527 -0.733 . . . . 0.0 109.117 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? 54.69 26.81 7.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.627 -0.67 . . . . 0.0 109.921 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.63 2.8 81.59 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -107.45 140.08 40.96 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.553 -0.969 . . . . 0.0 109.709 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -89.92 142.08 28.04 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.5 -0.75 . . . . 0.0 109.476 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -123.97 132.75 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -119.91 87.95 39.35 Favored Pre-proline 0 N--CA 1.496 1.835 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.66 149.4 68.12 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 122.734 2.289 . . . . 0.0 112.463 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.24 139.68 4.69 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 15' ' ' HIS . 45.2 p-80 -95.1 123.23 38.48 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.521 -0.988 . . . . 0.0 109.96 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -149.91 153.16 36.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.156 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -104.36 138.9 40.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.636 -0.665 . . . . 0.0 109.468 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -103.02 141.9 35.02 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.489 0.661 . . . . 0.0 110.349 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -68.77 -8.81 46.57 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.292 -0.88 . . . . 0.0 109.378 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -68.06 -52.86 30.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.49 ' CD1' ' H ' ' A' ' 23' ' ' LYS . 1.2 pp -108.26 7.27 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 40.89 37.92 0.59 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.823 -0.548 . . . . 0.0 110.123 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.49 ' H ' ' CD1' ' A' ' 21' ' ' ILE . 34.7 mmtt -141.16 176.79 8.55 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.352 -0.843 . . . . 0.0 109.706 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -86.82 127.43 35.01 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.303 0.573 . . . . 0.0 109.633 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -138.61 154.75 73.52 Favored Pre-proline 0 N--CA 1.493 1.681 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -58.52 110.29 0.63 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.239 1.959 . . . . 0.0 111.496 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -112.62 118.4 34.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.514 -0.741 . . . . 0.0 109.37 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 43' ' ' THR . . . -144.01 153.6 42.39 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -102.82 133.88 47.16 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.634 -0.666 . . . . 0.0 109.554 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.3 mt -110.0 128.07 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -136.41 138.86 41.98 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.628 -0.67 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -93.61 134.69 35.65 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.474 -0.766 . . . . 0.0 109.556 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.589 -0.694 . . . . 0.0 110.224 -179.554 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.1 m . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.54 143.49 55.87 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 122.35 2.034 . . . . 0.0 112.127 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.3 mp -124.03 125.04 25.89 Favored Pre-proline 0 N--CA 1.491 1.601 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -71.63 143.96 43.37 Favored 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 121.842 1.694 . . . . 0.0 112.278 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 28' ' ' ALA . 1.3 t -107.2 137.0 46.09 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -130.52 165.07 23.48 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.536 ' O ' ' N ' ' A' ' 47' ' ' GLU . 24.2 t80 -139.1 110.74 7.81 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -45.53 83.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.966 1.777 . . . . 0.0 112.33 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 45' ' ' TYR . 8.4 tm-20 -171.91 132.24 0.69 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.252 -0.905 . . . . 0.0 109.085 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -98.9 125.66 44.37 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 108.991 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.526 ' CE2' ' OE1' ' A' ' 47' ' ' GLU . 84.8 m-85 -109.03 -32.37 7.27 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.6 t0 62.97 -3.8 0.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.4 mt -115.47 131.54 56.9 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.595 -0.691 . . . . 0.0 109.737 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -68.47 -39.43 81.39 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.651 -0.656 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -50.34 74.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.74 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -64.34 -40.2 95.41 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.46 -0.775 . . . . 0.0 109.427 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.77 92.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.476 -0.765 . . . . 0.0 109.95 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -66.98 -49.37 65.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.403 -0.81 . . . . 0.0 110.1 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -64.98 -44.2 90.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.334 -0.854 . . . . 0.0 109.659 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.7 t -66.7 -42.37 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.56 -0.712 . . . . 0.0 109.564 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 p -54.72 -40.41 69.22 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.245 -0.909 . . . . 0.0 109.549 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -65.22 -45.02 95.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.204 -0.935 . . . . 0.0 109.368 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.34 51.83 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.404 -0.81 . . . . 0.0 109.733 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.1 m -60.92 -38.9 87.36 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.557 -0.715 . . . . 0.0 109.28 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.86 -41.12 70.42 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.46 -0.775 . . . . 0.0 109.188 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.18 -38.71 92.24 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.338 -0.852 . . . . 0.0 109.123 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.56 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.453 -0.779 . . . . 0.0 109.665 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.35 -44.35 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.339 -0.851 . . . . 0.0 108.746 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.68 -44.36 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.313 -0.867 . . . . 0.0 109.272 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.49 -41.51 96.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.563 -0.711 . . . . 0.0 109.573 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -61.58 -41.99 98.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.529 -0.732 . . . . 0.0 110.012 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -61.21 -47.16 87.4 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.125 -0.984 . . . . 0.0 109.467 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.87 -42.2 95.03 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.481 -0.762 . . . . 0.0 109.321 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 N--CA 1.487 1.401 0 O-C-N 121.553 -0.717 . . . . 0.0 109.653 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.689 -1.365 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.3 mt -112.16 32.68 5.35 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.959 . . . . 0.0 109.138 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.71 88.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.553 -0.717 . . . . 0.0 109.554 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.69 -34.77 79.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.595 -0.691 . . . . 0.0 109.899 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.2 mt -80.18 -2.93 46.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.617 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 CA-C-O 117.866 -1.519 . . . . 0.0 109.428 179.747 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.688 0.756 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.04 131.3 43.98 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.76 0.79 . . . . 0.0 109.706 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -83.86 149.26 26.49 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.671 0.748 . . . . 0.0 110.184 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -153.43 113.65 3.96 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.763 0.792 . . . . 0.0 109.401 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.8 mtp180 49.41 29.52 2.88 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.631 0.729 . . . . 0.0 110.104 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 96.23 -19.61 53.77 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -83.71 142.14 30.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -1.029 . . . . 0.0 110.625 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.49 145.81 24.53 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.624 -0.673 . . . . 0.0 109.604 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 94.6 mt -125.21 129.72 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-O 121.483 0.659 . . . . 0.0 109.483 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -123.68 93.23 47.73 Favored Pre-proline 0 N--CA 1.495 1.781 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.49 157.46 32.58 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.759 2.306 . . . . 0.0 113.209 -178.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.3 -133.71 1.75 Allowed Glycine 0 N--CA 1.488 2.153 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.545 ' ND1' ' OE2' ' A' ' 52' ' ' GLU . 20.2 p-80 -160.05 135.67 8.33 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.435 -1.038 . . . . 0.0 109.899 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.668 ' NE2' ' CE1' ' A' ' 27' ' ' TYR . 13.7 tt0 -166.62 154.4 9.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.639 -0.663 . . . . 0.0 109.301 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.9 p90 -112.79 144.62 42.01 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 121.711 0.767 . . . . 0.0 109.942 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.693 ' HE ' HG21 ' A' ' 44' ' ' THR . 94.6 mtt-85 -99.15 137.67 37.35 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.622 0.725 . . . . 0.0 109.969 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -68.21 -20.31 64.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.774 -0.579 . . . . 0.0 109.886 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -65.37 -42.43 92.75 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.314 -0.866 . . . . 0.0 109.917 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 11.4 pt -109.91 -6.16 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.47 -0.769 . . . . 0.0 109.016 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 48.25 44.13 19.45 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.807 0.813 . . . . 0.0 109.964 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -145.56 163.21 35.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.509 -0.745 . . . . 0.0 110.202 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -86.22 132.12 34.08 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.843 0.83 . . . . 0.0 110.229 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.8 m -142.49 148.72 48.22 Favored Pre-proline 0 N--CA 1.491 1.592 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -39.94 109.99 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.395 2.063 . . . . 0.0 111.416 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.668 ' CE1' ' NE2' ' A' ' 16' ' ' GLN . 56.1 t80 -104.08 120.29 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.603 0.716 . . . . 0.0 109.961 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.617 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -142.13 145.8 34.65 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.496 -0.753 . . . . 0.0 109.097 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.41 HD21 ' CE2' ' A' ' 27' ' ' TYR . 65.7 mt -110.14 126.57 54.2 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 91.0 mt -104.05 127.45 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.516 0.674 . . . . 0.0 109.532 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -130.1 137.98 50.45 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.59 0.71 . . . . 0.0 109.464 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -95.2 130.53 41.9 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 109.28 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.3 -179.252 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.71 144.14 98.2 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.348 2.032 . . . . 0.0 112.393 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.14 89.97 51.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -52.87 141.6 55.04 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 C-N-CA 122.517 2.145 . . . . 0.0 112.227 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.617 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 12.1 t -108.65 134.61 51.15 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.812 0.815 . . . . 0.0 110.003 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.693 HG21 ' HE ' ' A' ' 18' ' ' ARG . 56.9 p -139.66 166.85 23.5 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.608 ' O ' ' N ' ' A' ' 47' ' ' GLU . 8.8 t80 -136.05 133.42 19.7 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -42.78 76.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.898 2.399 . . . . 0.0 112.382 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.608 ' N ' ' O ' ' A' ' 45' ' ' TYR . 39.8 mt-10 -155.06 145.05 21.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.564 -0.71 . . . . 0.0 109.131 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -115.39 110.15 18.93 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.696 -0.628 . . . . 0.0 109.345 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.419 ' CE2' HG21 ' A' ' 58' ' ' VAL . 48.6 m-85 -124.28 129.79 51.37 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.557 0.694 . . . . 0.0 109.669 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -92.99 -24.84 18.23 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -78.68 143.02 36.67 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.826 0.822 . . . . 0.0 110.323 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.545 ' OE2' ' ND1' ' A' ' 15' ' ' HIS . 46.2 tp10 -71.89 -38.49 69.97 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.578 0.704 . . . . 0.0 109.758 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.97 87.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.79 . . . . 0.0 109.862 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 58' ' ' VAL . 34.9 m-20 -63.68 -43.43 96.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 109.739 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.12 88.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.512 -0.743 . . . . 0.0 109.899 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -69.37 -45.08 70.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.487 -0.758 . . . . 0.0 110.08 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -64.07 -45.4 88.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.335 -0.853 . . . . 0.0 110.037 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.419 HG21 ' CE2' ' A' ' 49' ' ' TYR . 75.7 t -67.53 -41.79 86.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.558 0.694 . . . . 0.0 109.742 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.52 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 88.1 p -57.18 -42.43 81.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.37 -0.831 . . . . 0.0 110.045 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.87 -45.07 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.117 -0.989 . . . . 0.0 109.645 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.89 -49.45 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.222 -0.924 . . . . 0.0 109.805 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.1 m -61.82 -35.19 77.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.473 -0.767 . . . . 0.0 109.485 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.55 -41.03 89.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.395 -0.815 . . . . 0.0 109.523 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.26 -45.74 86.78 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.296 -0.877 . . . . 0.0 109.805 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.404 ' N ' HD12 ' A' ' 65' ' ' ILE . 3.0 mp -67.47 -42.08 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.369 -0.832 . . . . 0.0 109.818 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -62.22 -43.74 98.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 121.384 -0.822 . . . . 0.0 109.789 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.95 -44.71 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.228 -0.92 . . . . 0.0 109.319 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.457 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 73.9 m-20 -64.24 -44.06 92.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.378 -0.826 . . . . 0.0 109.264 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.2 p -64.47 -47.6 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 0.0 109.768 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.465 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 17.8 t-80 -47.06 -44.02 20.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.293 -0.879 . . . . 0.0 109.441 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.402 HD13 HH22 ' A' ' 7' ' ' ARG . 90.0 mt -63.34 -40.72 98.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.38 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 N--CA 1.497 1.894 0 O-C-N 121.453 -0.779 . . . . 0.0 109.266 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.465 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 59.5 mt -102.59 14.65 31.42 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.326 -1.102 . . . . 0.0 109.201 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.12 -26.08 68.38 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.505 -0.747 . . . . 0.0 109.9 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -68.08 -17.16 64.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.325 -0.859 . . . . 0.0 109.676 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.9 mt -92.93 -2.13 56.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.186 -0.947 . . . . 0.0 109.262 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.807 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.8 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.666 0.746 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.8 139.89 48.05 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -101.63 122.48 43.95 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.737 0.779 . . . . 0.0 109.876 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -101.69 -101.12 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.403 0.621 . . . . 0.0 109.509 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -90.96 51.46 1.96 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.361 -0.837 . . . . 0.0 109.546 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.7 90.51 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.06 138.19 44.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.506 -0.997 . . . . 0.0 109.896 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -80.45 141.07 35.6 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.629 -0.669 . . . . 0.0 109.379 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.6 mt -119.47 129.0 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.38 0.61 . . . . 0.0 109.448 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -132.22 97.97 17.58 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -76.94 154.11 33.3 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.622 2.215 . . . . 0.0 112.868 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.2 102.89 0.17 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -42.05 129.68 3.6 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.69 -0.888 . . . . 0.0 110.713 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.441 ' CD ' ' H ' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -156.93 158.1 36.02 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.614 0.721 . . . . 0.0 109.427 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.441 ' H ' ' CD ' ' A' ' 16' ' ' GLN . 48.3 p90 -113.5 145.8 40.63 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.817 0.817 . . . . 0.0 110.038 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.636 HH21 ' CG2' ' A' ' 44' ' ' THR . 32.3 mmt180 -92.51 130.75 38.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.767 0.794 . . . . 0.0 109.612 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 45.1 p-10 -71.72 -23.78 61.68 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.73 -0.606 . . . . 0.0 109.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 90.7 m-20 -61.79 -44.64 96.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.6 pt -109.39 -7.63 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.378 -0.826 . . . . 0.0 109.102 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 54.8 53.43 10.51 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.591 0.71 . . . . 0.0 110.197 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -146.53 162.36 38.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.383 -0.823 . . . . 0.0 110.377 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -88.14 128.53 35.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.617 -0.677 . . . . 0.0 109.664 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.8 m -147.14 148.24 31.45 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.484 -0.76 . . . . 0.0 109.391 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -42.47 109.23 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 122.282 1.988 . . . . 0.0 111.508 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.407 ' OH ' HD21 ' A' ' 29' ' ' LEU . 75.0 t80 -112.39 120.96 43.47 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.347 -0.846 . . . . 0.0 110.163 -179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.807 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -137.72 145.67 42.79 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.427 HD13 ' NH2' ' A' ' 31' ' ' ARG . 83.1 mt -101.78 130.26 48.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.537 -0.727 . . . . 0.0 109.301 -179.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 93.1 mt -109.64 124.4 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 CA-C-O 121.579 0.704 . . . . 0.0 109.901 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.427 ' NH2' HD13 ' A' ' 29' ' ' LEU . 3.9 mpt_? -130.61 140.44 50.42 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.644 0.735 . . . . 0.0 109.572 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -86.9 137.25 32.54 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-O 121.606 0.717 . . . . 0.0 109.643 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.806 0.812 . . . . 0.0 110.583 -179.459 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 N--CA 1.495 1.797 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.08 146.91 46.14 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.427 2.085 . . . . 0.0 112.721 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -109.75 111.02 59.19 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.55 157.42 44.67 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.546 2.164 . . . . 0.0 112.461 -179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.807 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 1.0 OUTLIER -121.97 135.55 54.86 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.577 0.703 . . . . 0.0 109.71 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.636 ' CG2' HH21 ' A' ' 18' ' ' ARG . 43.7 p -131.03 166.84 20.14 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' A' ' 47' ' ' GLU . 1.1 t80 -135.58 133.19 20.08 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.509 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 77.1 Cg_exo -45.23 -12.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.313 2.009 . . . . 0.0 111.468 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' TYR . 97.0 mt-10 -84.0 160.27 21.05 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.57 -0.706 . . . . 0.0 109.937 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -131.28 148.65 52.71 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.598 0.713 . . . . 0.0 109.362 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.527 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 62.4 m-85 -149.62 118.91 6.82 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.477 -0.765 . . . . 0.0 109.241 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -74.12 -13.39 60.82 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -94.67 128.54 41.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 109.877 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -67.79 -36.15 79.93 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.483 0.659 . . . . 0.0 110.19 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.36 -43.87 92.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.365 -0.834 . . . . 0.0 109.753 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 51.3 t0 -65.94 -38.85 89.7 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.417 -0.802 . . . . 0.0 109.544 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.95 -37.07 86.07 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.531 -0.731 . . . . 0.0 109.595 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -64.48 -50.24 68.23 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.392 -0.818 . . . . 0.0 109.807 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -67.27 -44.06 80.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.833 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 54' ' ' ASP . 74.4 t -67.4 -42.98 87.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.457 -0.777 . . . . 0.0 110.238 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.487 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 77.8 p -59.6 -41.08 89.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 110.206 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -65.83 -44.44 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 120.987 -1.07 . . . . 0.0 109.473 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -45.2 76.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.437 -0.789 . . . . 0.0 109.898 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.57 -46.38 72.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.361 -0.837 . . . . 0.0 109.985 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -48.2 -46.15 34.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.448 -0.783 . . . . 0.0 109.799 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.34 -41.82 98.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.361 -0.837 . . . . 0.0 109.418 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 91.0 mt -64.47 -44.03 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.505 -0.747 . . . . 0.0 109.691 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.15 -43.99 99.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.01 -44.03 99.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 O-C-N 121.583 -0.698 . . . . 0.0 109.2 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.23 -42.62 93.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.668 0.747 . . . . 0.0 109.301 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.7 t -69.92 -34.12 73.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.554 -0.716 . . . . 0.0 109.789 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.698 ' CD2' HD12 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -57.75 -47.74 81.62 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.282 -0.886 . . . . 0.0 108.78 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.435 ' HG ' ' CD2' ' A' ' 70' ' ' HIS . 77.5 mt -64.25 -40.32 95.77 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.9 t0 . . . . . 0 C--N 1.298 -1.672 0 CA-C-O 121.508 0.67 . . . . 0.0 109.711 179.599 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.916 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.698 HD12 ' CD2' ' A' ' 70' ' ' HIS . 46.5 mt -109.84 32.96 4.67 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.514 -0.992 . . . . 0.0 108.854 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.42 76.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.519 -0.738 . . . . 0.0 109.315 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.92 -37.44 87.4 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.424 -0.797 . . . . 0.0 109.261 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.5 mt -86.8 -5.69 59.04 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.096 -1.002 . . . . 0.0 108.805 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.92 -1.489 . . . . 0.0 109.413 179.507 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 121.813 0.816 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.29 146.77 31.1 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -102.83 136.9 41.8 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.741 0.781 . . . . 0.0 110.217 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -149.38 120.69 7.85 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.77 0.795 . . . . 0.0 109.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 48.98 30.84 2.96 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.741 0.781 . . . . 0.0 110.452 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.32 -20.26 41.85 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -81.02 144.16 31.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.341 -1.093 . . . . 0.0 110.299 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -104.32 139.07 39.83 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -115.01 137.57 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.648 0.737 . . . . 0.0 110.122 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -118.65 90.0 38.74 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.62 145.85 46.33 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.947 2.431 . . . . 0.0 112.907 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.28 -171.95 40.53 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -149.15 141.02 23.68 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.999 . . . . 0.0 109.773 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -170.02 155.74 5.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.587 -0.696 . . . . 0.0 109.514 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -105.3 137.9 42.36 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.861 0.838 . . . . 0.0 110.146 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.4 141.16 36.44 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.389 0.614 . . . . 0.0 109.585 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 37.4 p-10 -68.44 -8.28 39.3 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.756 0.789 . . . . 0.0 109.349 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -64.27 -42.44 96.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.392 -0.818 . . . . 0.0 109.205 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.412 ' O ' ' C ' ' A' ' 22' ' ' ARG . 1.1 pp -122.58 12.71 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ILE . 89.0 mtm180 38.48 34.62 0.08 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.632 0.729 . . . . 0.0 110.102 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -138.35 169.12 18.35 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.054 0.931 . . . . 0.0 110.359 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -85.3 135.37 33.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.635 0.731 . . . . 0.0 109.891 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -147.37 147.64 28.94 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.377 -0.827 . . . . 0.0 109.493 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -38.19 109.21 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 C-N-CA 122.685 2.257 . . . . 0.0 111.65 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -109.05 112.0 23.94 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.16 145.7 37.84 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.529 -0.732 . . . . 0.0 109.424 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.92 124.87 49.25 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -112.36 133.26 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-O 121.461 0.648 . . . . 0.0 109.797 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.99 138.33 43.89 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.613 0.721 . . . . 0.0 109.355 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -83.28 134.76 34.92 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.707 0.765 . . . . 0.0 110.267 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.1 t . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.732 0.777 . . . . 0.0 110.5 -179.727 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.76 151.96 52.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.71 2.274 . . . . 0.0 112.984 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.509 HD11 ' HB2' ' A' ' 80' ' ' ASP . 4.2 mp -118.38 130.89 24.49 Favored Pre-proline 0 N--CA 1.495 1.78 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.04 145.98 45.88 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.523 2.148 . . . . 0.0 112.246 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.9 t -116.52 137.13 52.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.703 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -138.22 167.65 21.38 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.309 0.576 . . . . 0.0 109.666 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -126.83 145.21 52.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.48 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 81.6 Cg_exo -43.2 -26.31 0.82 Allowed 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.24 1.96 . . . . 0.0 111.574 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -69.73 160.4 31.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.744 . . . . 0.0 110.515 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 46' ' ' PRO . 73.2 m-85 -128.37 146.55 50.74 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.544 0.688 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.518 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 71.8 m-85 -148.55 121.91 9.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.469 -0.769 . . . . 0.0 109.877 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -82.59 -20.18 36.98 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -81.77 136.31 35.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.34 -0.85 . . . . 0.0 109.881 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.86 -40.58 72.23 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.61 0.719 . . . . 0.0 109.778 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.96 99.23 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.411 -0.806 . . . . 0.0 109.807 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.518 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 54.1 t0 -65.26 -39.63 92.9 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.41 -0.806 . . . . 0.0 109.906 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.1 95.0 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.261 -0.899 . . . . 0.0 109.839 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.94 -46.02 76.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.31 -0.869 . . . . 0.0 109.858 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.57 -44.3 91.12 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.236 -0.915 . . . . 0.0 109.95 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.3 t -66.83 -41.71 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.496 -0.752 . . . . 0.0 109.906 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 88.2 p -56.95 -41.28 78.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.325 -0.86 . . . . 0.0 109.989 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.12 -45.76 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.023 -1.048 . . . . 0.0 109.66 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.52 -53.72 26.17 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.271 -0.893 . . . . 0.0 109.929 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.7 m -62.95 -35.66 80.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.387 -0.821 . . . . 0.0 109.809 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.51 ' HB2' ' O ' ' A' ' 59' ' ' SER . . . -55.65 -43.26 76.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.165 -0.96 . . . . 0.0 108.818 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -63.16 -39.66 95.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 0.0 108.747 179.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -64.92 -43.62 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.308 -0.87 . . . . 0.0 108.736 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.0 mm -64.29 -43.93 97.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.725 0.774 . . . . 0.0 109.555 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -64.21 -44.24 97.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 O-C-N 121.464 -0.772 . . . . 0.0 109.4 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -64.88 -45.22 86.9 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.81 0.814 . . . . 0.0 109.554 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -62.78 -38.95 92.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.429 -0.794 . . . . 0.0 109.868 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.499 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 79.4 t60 -60.82 -40.95 94.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.21 -0.931 . . . . 0.0 109.852 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.09 -41.73 99.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.373 -0.829 . . . . 0.0 109.823 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.16 -0.962 . . . . 0.0 108.991 179.657 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.499 ' O ' ' CE1' ' A' ' 70' ' ' HIS . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.3 mt 59.65 1.16 0.27 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.724 -0.868 . . . . 0.0 109.58 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.17 -34.46 78.13 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.483 -0.761 . . . . 0.0 109.431 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.509 ' HB2' HD11 ' A' ' 41' ' ' ILE . 98.5 m-20 -61.98 -41.05 97.6 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.251 -0.906 . . . . 0.0 109.794 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.53 -40.32 96.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.301 -0.875 . . . . 0.0 109.477 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 -179.899 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.498 0.666 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.18 137.42 51.48 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.696 0.76 . . . . 0.0 109.792 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -82.25 151.2 26.92 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.614 0.721 . . . . 0.0 110.086 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -154.51 111.84 3.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.445 ' NH2' ' CD1' ' A' ' 71' ' ' LEU . 84.1 mtp180 49.75 35.59 9.33 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.69 0.757 . . . . 0.0 110.534 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.32 -5.76 83.87 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -105.41 137.34 43.37 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.239 -1.154 . . . . 0.0 110.252 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -89.22 144.85 25.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.746 -0.596 . . . . 0.0 109.461 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.74 130.04 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-O 121.424 0.63 . . . . 0.0 109.391 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.594 ' O ' ' HB1' ' A' ' 28' ' ' ALA . 49.6 tt0 -121.26 117.95 30.27 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.98 154.22 42.44 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.609 2.206 . . . . 0.0 113.023 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.43 -167.3 39.2 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -151.07 156.01 40.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.511 -0.993 . . . . 0.0 109.509 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 57.4 tt0 -152.98 154.1 34.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.544 -0.723 . . . . 0.0 109.08 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -107.95 123.92 49.36 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.777 0.799 . . . . 0.0 110.159 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -96.92 138.3 34.68 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.797 0.808 . . . . 0.0 109.41 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -86.94 -24.29 24.82 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 109.41 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.32 -44.91 93.6 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.432 -0.793 . . . . 0.0 109.543 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.433 ' O ' ' C ' ' A' ' 22' ' ' ARG . 19.7 pt -105.6 9.99 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.449 -0.782 . . . . 0.0 108.994 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.433 ' C ' ' O ' ' A' ' 21' ' ' ILE . 51.8 ptt85 35.8 41.78 0.12 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.655 0.741 . . . . 0.0 110.803 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -146.71 160.63 41.99 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.312 -0.868 . . . . 0.0 110.427 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -85.54 137.48 32.85 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 121.536 0.684 . . . . 0.0 109.854 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.3 m -139.39 151.63 67.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.673 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -45.42 134.3 12.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.429 2.086 . . . . 0.0 112.223 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 71.9 t80 -140.31 113.81 8.64 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.378 -0.826 . . . . 0.0 109.56 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.594 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -138.69 151.12 46.89 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.584 0.707 . . . . 0.0 109.267 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.8 mt -101.74 128.34 48.11 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.481 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 95.1 mt -108.62 129.55 62.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -117.04 136.11 53.21 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.717 0.77 . . . . 0.0 109.356 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -101.89 117.91 35.83 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.759 0.79 . . . . 0.0 109.323 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 6.4 t . . . . . 0 C--N 1.3 -1.583 0 CA-C-O 121.606 0.717 . . . . 0.0 109.881 -179.903 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.58 131.75 17.86 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.509 2.139 . . . . 0.0 112.623 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.49 106.63 52.23 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.783 -0.573 . . . . 0.0 109.583 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.478 ' CB ' ' CE1' ' A' ' 27' ' ' TYR . 59.4 Cg_endo -75.6 146.73 30.89 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.472 2.114 . . . . 0.0 112.242 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.15 132.37 53.68 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.612 0.72 . . . . 0.0 109.715 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 p -136.41 167.13 21.91 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.389 0.614 . . . . 0.0 109.605 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -131.65 142.14 44.2 Favored Pre-proline 0 N--CA 1.492 1.657 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -45.98 -35.26 14.03 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.197 1.931 . . . . 0.0 111.576 178.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.48 144.67 56.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.52 -0.738 . . . . 0.0 110.01 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -125.51 148.11 49.0 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.66 0.743 . . . . 0.0 109.847 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.67 129.85 33.39 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.745 0.783 . . . . 0.0 109.497 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 64.7 t0 -66.86 -35.66 80.54 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.563 0.697 . . . . 0.0 109.523 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 72.4 mt -75.21 135.41 41.03 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.953 0.882 . . . . 0.0 110.342 -179.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 56' ' ' GLU . 1.7 tm-20 -72.47 -40.05 67.25 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.717 0.77 . . . . 0.0 109.715 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.2 96.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.394 -0.816 . . . . 0.0 109.872 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -64.17 -36.49 84.21 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.323 -0.86 . . . . 0.0 109.25 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.64 89.68 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.403 -0.811 . . . . 0.0 109.182 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 52' ' ' GLU . 97.2 mt-10 -64.39 -45.3 88.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.433 -0.792 . . . . 0.0 109.491 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -64.32 -43.86 93.37 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.375 -0.828 . . . . 0.0 109.677 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.3 -41.55 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.495 -0.753 . . . . 0.0 109.577 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 95.3 p -57.53 -40.38 78.68 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.409 -0.807 . . . . 0.0 109.686 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.78 -46.07 93.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.187 -0.946 . . . . 0.0 109.471 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.75 -52.64 41.91 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.118 -0.988 . . . . 0.0 109.4 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 92.6 m -59.53 -40.28 86.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.314 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 59' ' ' SER . . . -52.97 -40.13 63.5 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.559 -0.713 . . . . 0.0 109.69 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -61.51 -41.18 96.92 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.222 -0.924 . . . . 0.0 109.311 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.527 ' N ' HD12 ' A' ' 65' ' ' ILE . 1.4 mp -63.92 -43.85 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.26 -0.9 . . . . 0.0 109.542 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.89 -43.22 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.26 -0.9 . . . . 0.0 109.131 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.3 mt -62.77 -43.78 99.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.213 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -64.32 -43.73 93.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.399 -0.813 . . . . 0.0 109.395 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -63.57 -35.92 82.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.443 -0.785 . . . . 0.0 109.389 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.527 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 64.0 t60 -58.83 -42.86 90.25 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.365 -0.834 . . . . 0.0 109.621 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.445 ' CD1' ' NH2' ' A' ' 7' ' ' ARG . 96.3 mt -63.72 -41.25 98.11 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.356 -0.84 . . . . 0.0 109.093 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 t70 . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 109.229 179.837 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 77' ' ' GLY . 47.5 mt 37.63 34.59 0.05 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.83 0.824 . . . . 0.0 109.575 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.97 85.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.498 -0.751 . . . . 0.0 109.741 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -64.82 -35.43 81.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.213 -0.93 . . . . 0.0 109.186 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.96 -4.41 58.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.209 -0.932 . . . . 0.0 109.257 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.468 0 CA-C-O 117.881 -1.51 . . . . 0.0 109.566 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.497 1.911 0 CA-C-O 121.427 0.632 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.92 159.33 15.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.435 -0.791 . . . . 0.0 109.248 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -109.73 143.45 39.51 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.471 -0.768 . . . . 0.0 109.556 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -152.83 124.38 7.74 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.296 -0.878 . . . . 0.0 109.308 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 53.74 26.04 5.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.621 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.31 2.24 87.76 Favored Glycine 0 N--CA 1.495 2.619 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.94 140.58 38.73 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.35 -1.088 . . . . 0.0 109.554 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.514 -0.741 . . . . 0.0 109.41 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -124.76 130.01 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -114.98 113.29 44.19 Favored Pre-proline 0 N--CA 1.497 1.925 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.82 157.34 47.82 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.815 1.677 . . . . 0.0 112.79 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.7 -163.78 37.48 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -148.92 146.3 27.81 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.065 -1.256 . . . . 0.0 109.511 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.48 ' CD ' ' N ' ' A' ' 17' ' ' TYR . 6.5 tm0? -167.61 147.29 5.06 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.31 -0.868 . . . . 0.0 109.087 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.48 ' N ' ' CD ' ' A' ' 16' ' ' GLN . 49.5 p90 -107.63 137.86 44.9 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.4 mtp180 -89.04 136.04 33.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.929 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -71.07 -18.99 62.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -62.21 -45.46 93.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.322 -0.861 . . . . 0.0 109.744 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.11 -2.36 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 48.32 50.27 16.73 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.582 -0.699 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -139.55 157.28 46.08 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.408 -0.808 . . . . 0.0 109.07 178.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -85.73 131.66 34.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.626 -0.672 . . . . 0.0 109.78 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.0 148.75 36.63 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.252 -0.905 . . . . 0.0 109.344 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.74 110.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.325 2.016 . . . . 0.0 111.608 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -108.07 113.2 26.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.153 -0.967 . . . . 0.0 109.234 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.55 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -137.49 154.3 49.91 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.4 -0.813 . . . . 0.0 108.858 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.7 mt -109.69 129.64 55.59 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.6 mt -107.23 128.64 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.683 -0.636 . . . . 0.0 109.399 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -130.43 138.48 50.34 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -82.41 137.98 34.56 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.405 -0.81 . . . . 0.0 109.498 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.1 t . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.403 -0.811 . . . . 0.0 109.851 -179.381 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.63 143.42 68.91 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.124 1.882 . . . . 0.0 112.326 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 24.2 mm -106.01 130.76 22.48 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.313 -0.867 . . . . 0.0 108.734 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.2 148.49 39.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.763 1.642 . . . . 0.0 112.121 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.55 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 10.2 t -120.43 133.58 55.4 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.3 p -136.19 167.75 20.69 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -128.33 143.72 49.18 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.542 -0.724 . . . . 0.0 109.388 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -44.04 -27.36 1.75 Allowed 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 121.939 1.759 . . . . 0.0 112.008 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.24 165.01 14.67 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.396 -0.815 . . . . 0.0 109.917 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -128.4 148.06 50.68 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -150.61 110.88 4.17 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.084 -1.01 . . . . 0.0 109.667 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 68.3 t0 -66.69 -33.58 75.95 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.692 -0.63 . . . . 0.0 109.938 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.0 mt -79.35 138.19 37.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.165 -0.96 . . . . 0.0 110.953 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -70.74 -36.88 73.36 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.567 0.699 . . . . 0.0 109.416 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.29 -49.26 77.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.91 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.59 -36.18 83.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.381 -0.824 . . . . 0.0 108.938 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.25 97.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.33 -0.856 . . . . 0.0 109.563 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.16 -50.02 65.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.271 -0.893 . . . . 0.0 110.194 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -62.92 -44.57 95.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.281 -0.887 . . . . 0.0 109.647 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.28 -42.39 93.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.351 -0.843 . . . . 0.0 109.733 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.532 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 93.8 p -55.82 -40.51 72.87 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.711 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.403 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.4 mt -64.3 -45.32 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.053 -1.029 . . . . 0.0 109.457 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.31 -49.19 62.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.351 -0.843 . . . . 0.0 109.681 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.9 m -62.91 -34.79 78.18 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.529 -0.732 . . . . 0.0 109.436 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.8 -41.8 92.02 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.377 -0.827 . . . . 0.0 109.353 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.403 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 64.7 mttp -62.92 -44.7 95.37 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.197 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.59 -43.51 86.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.481 -0.762 . . . . 0.0 109.21 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.1 mm -62.31 -44.74 99.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.55 -45.05 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.035 -1.041 . . . . 0.0 109.603 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -67.08 -51.59 52.48 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.863 . . . . 0.0 109.741 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.9 m -62.09 -41.45 98.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 109.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.505 ' CE1' ' HB2' ' A' ' 78' ' ' LEU . 18.6 t-80 -53.19 -43.79 67.43 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.376 -0.827 . . . . 0.0 109.432 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.4 mt -62.61 -42.03 99.33 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.352 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 p30 . . . . . 0 N--CA 1.497 1.908 0 O-C-N 121.36 -0.837 . . . . 0.0 109.997 -179.917 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.493 2.452 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.505 ' HB2' ' CE1' ' A' ' 70' ' ' HIS . 45.8 mt -73.61 37.03 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.129 -1.218 . . . . 0.0 110.21 -178.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -65.44 -35.62 81.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.362 -0.837 . . . . 0.0 109.768 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -62.57 -35.44 79.52 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.383 -0.823 . . . . 0.0 108.986 -179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.24 -2.64 53.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.409 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.584 179.734 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 m . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.514 0.673 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.56 138.23 50.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.586 0.708 . . . . 0.0 109.478 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -91.67 138.91 31.18 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.524 0.678 . . . . 0.0 110.04 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -149.4 121.87 8.51 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.532 -0.73 . . . . 0.0 109.608 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 52.89 29.17 7.36 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.623 0.725 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.97 1.37 88.83 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -105.06 139.86 39.1 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.458 -1.025 . . . . 0.0 109.895 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -87.4 139.67 30.32 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.9 mt -123.16 129.83 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 121.387 0.613 . . . . 0.0 109.463 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -121.05 92.46 48.51 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.68 148.35 22.76 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.759 2.306 . . . . 0.0 112.801 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.95 161.83 29.77 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -93.88 124.98 38.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.642 -0.917 . . . . 0.0 109.921 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -149.4 153.53 37.51 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.613 -0.679 . . . . 0.0 109.514 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -108.32 136.74 47.46 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.614 0.721 . . . . 0.0 109.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -96.39 138.74 33.53 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.631 0.729 . . . . 0.0 109.756 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.72 -24.59 65.39 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.542 0.687 . . . . 0.0 109.804 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -61.09 -45.1 96.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 110.335 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.9 pt -110.25 -5.07 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.404 -0.81 . . . . 0.0 109.313 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 49.14 42.23 20.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.658 0.742 . . . . 0.0 109.873 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -144.57 165.4 28.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 110.098 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -85.26 128.31 34.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.619 0.723 . . . . 0.0 110.043 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.7 m -146.82 148.07 31.85 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.531 -0.73 . . . . 0.0 109.192 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -40.93 110.31 0.12 Allowed 'Trans proline' 0 C--N 1.315 -1.223 0 C-N-CA 122.503 2.135 . . . . 0.0 112.091 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.415 ' OH ' HD21 ' A' ' 29' ' ' LEU . 82.1 t80 -114.59 119.87 38.24 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.722 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -138.67 145.05 39.94 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.61 -0.681 . . . . 0.0 109.259 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.415 HD21 ' OH ' ' A' ' 27' ' ' TYR . 64.4 mt -106.27 131.93 52.91 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -114.7 127.46 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 CA-C-O 121.374 0.607 . . . . 0.0 109.487 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -134.26 133.97 41.4 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.451 0.643 . . . . 0.0 109.267 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -81.97 137.63 35.1 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.643 0.735 . . . . 0.0 110.15 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.0 t . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.607 0.717 . . . . 0.0 110.192 -179.763 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.59 143.66 77.96 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.77 2.313 . . . . 0.0 112.528 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.5 ' N ' HD12 ' A' ' 41' ' ' ILE . 3.7 mp -116.38 130.96 24.09 Favored Pre-proline 0 N--CA 1.491 1.593 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.51 149.01 38.54 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.469 2.113 . . . . 0.0 112.461 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.722 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.5 OUTLIER -111.09 133.01 53.79 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -134.85 162.06 33.47 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.611 0.72 . . . . 0.0 109.574 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.623 ' O ' ' N ' ' A' ' 47' ' ' GLU . 12.9 t80 -143.15 135.25 13.19 Favored Pre-proline 0 N--CA 1.487 1.416 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -43.29 76.73 0.01 OUTLIER 'Trans proline' 0 N--CA 1.499 1.797 0 C-N-CA 122.857 2.371 . . . . 0.0 112.207 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.623 ' N ' ' O ' ' A' ' 45' ' ' TYR . 71.1 mm-40 -148.91 148.39 29.78 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.481 -0.762 . . . . 0.0 109.387 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -127.31 118.91 25.1 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -140.51 131.1 25.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.636 -0.665 . . . . 0.0 109.812 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -91.35 -25.43 19.4 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -76.16 143.6 41.06 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.64 0.733 . . . . 0.0 109.972 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -73.1 -40.64 64.82 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.43 0.633 . . . . 0.0 110.176 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.05 92.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.368 -0.832 . . . . 0.0 109.853 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.11 -42.49 96.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.359 -0.838 . . . . 0.0 109.839 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.76 -43.57 88.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.387 -0.821 . . . . 0.0 109.825 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.99 -44.89 75.58 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.804 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -63.85 -45.56 88.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.477 -0.765 . . . . 0.0 109.725 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.13 -42.16 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.579 -0.7 . . . . 0.0 109.777 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.416 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 77.9 p -54.73 -41.62 70.58 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.442 -0.786 . . . . 0.0 109.856 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.66 -44.62 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 109.481 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.09 91.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.391 -0.818 . . . . 0.0 109.654 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.35 -46.41 73.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.326 -0.859 . . . . 0.0 109.701 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.37 -43.41 44.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.438 -0.789 . . . . 0.0 109.502 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.74 -42.59 97.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.577 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.3 -44.64 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.387 -0.821 . . . . 0.0 109.997 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.2 -44.59 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.489 -0.757 . . . . 0.0 109.314 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.4 mt -64.7 -44.33 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -66.15 -44.22 84.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.505 -0.747 . . . . 0.0 109.906 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.3 t -65.66 -40.36 92.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.358 -0.839 . . . . 0.0 110.1 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -59.23 -42.1 90.25 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.903 . . . . 0.0 109.673 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.8 -42.97 99.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.445 -0.784 . . . . 0.0 109.858 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 . . . . . 0 C--N 1.302 -1.496 0 O-C-N 121.382 -0.824 . . . . 0.0 109.584 -179.879 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -102.91 17.1 24.79 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.377 -1.072 . . . . 0.0 109.682 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.49 -28.3 69.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.323 -0.86 . . . . 0.0 109.335 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.456 ' HB3' HD11 ' A' ' 41' ' ' ILE . 68.0 t0 -64.16 -32.96 74.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.535 -0.728 . . . . 0.0 109.518 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.6 mt -79.59 -3.94 49.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.37 -0.831 . . . . 0.0 109.797 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.019 -1.434 . . . . 0.0 109.744 179.908 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.778 0.799 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.68 159.58 15.15 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.525 0.679 . . . . 0.0 109.775 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -111.64 152.98 27.03 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.738 0.78 . . . . 0.0 110.239 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -139.94 -134.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.671 0.748 . . . . 0.0 109.934 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -72.65 51.99 0.28 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.754 0.788 . . . . 0.0 110.067 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.87 -6.86 82.64 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -105.99 138.7 41.72 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.339 -1.095 . . . . 0.0 110.34 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -85.6 144.7 27.73 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.359 0.599 . . . . 0.0 109.498 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.9 mt -125.32 132.1 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 121.5 0.667 . . . . 0.0 109.877 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -126.03 124.29 24.63 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.1 157.18 38.25 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.608 2.205 . . . . 0.0 112.729 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.69 -169.32 42.26 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.509 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 47.4 p-80 -148.76 146.85 28.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.768 -0.842 . . . . 0.0 109.767 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -169.78 151.35 4.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -109.3 142.95 39.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 121.887 0.851 . . . . 0.0 110.261 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -94.58 136.23 35.12 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.869 0.843 . . . . 0.0 109.477 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 42.3 p30 -68.0 -20.0 64.98 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.424 0.631 . . . . 0.0 109.673 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 98.9 m-20 -62.38 -42.16 99.2 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.5 -0.75 . . . . 0.0 109.639 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.2 pt -115.56 -3.13 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.573 -0.704 . . . . 0.0 109.281 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 49.16 40.54 17.92 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.632 -0.667 . . . . 0.0 109.988 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -135.83 161.16 36.39 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.651 0.739 . . . . 0.0 110.38 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -86.44 128.33 34.94 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 121.574 0.702 . . . . 0.0 109.85 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -137.3 147.6 58.8 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.97 108.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.248 0 C-N-CA 122.631 2.221 . . . . 0.0 112.057 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -106.33 116.97 32.85 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.487 0.66 . . . . 0.0 109.645 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.733 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -135.11 141.78 46.08 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.681 0.753 . . . . 0.0 109.079 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.2 mt -105.08 127.08 52.72 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.65 0.738 . . . . 0.0 109.309 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -115.16 130.46 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.458 0.647 . . . . 0.0 109.465 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.96 134.85 47.72 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.912 0.863 . . . . 0.0 109.672 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -82.6 137.33 34.56 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.872 0.844 . . . . 0.0 110.202 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.9 t . . . . . 0 C--N 1.3 -1.57 0 CA-C-O 121.676 0.751 . . . . 0.0 110.199 -179.772 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.64 145.53 29.86 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.18 1.92 . . . . 0.0 112.427 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.9 mm -114.82 95.39 41.04 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.17 142.94 43.91 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.7 2.267 . . . . 0.0 112.447 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.733 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -107.74 138.38 44.09 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.692 0.758 . . . . 0.0 110.102 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.2 p -139.24 166.65 23.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.497 0.665 . . . . 0.0 109.48 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.59 ' O ' ' N ' ' A' ' 47' ' ' GLU . 39.9 t80 -137.66 138.29 23.9 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.33 72.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.776 0 C-N-CA 122.863 2.375 . . . . 0.0 112.337 178.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.59 ' N ' ' O ' ' A' ' 45' ' ' TYR . 17.3 pt-20 -173.06 143.45 1.15 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.393 -0.817 . . . . 0.0 109.313 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -125.2 149.61 47.78 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.678 0.752 . . . . 0.0 109.832 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -137.77 131.3 31.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.609 0.719 . . . . 0.0 109.6 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -74.1 -16.4 61.02 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -96.6 130.56 43.77 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.791 0.805 . . . . 0.0 109.443 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.509 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 83.3 tt0 -69.02 -37.36 78.6 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.262 0.553 . . . . 0.0 110.397 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.84 95.1 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.188 -0.945 . . . . 0.0 109.649 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.96 -39.84 95.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.538 -0.726 . . . . 0.0 109.432 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.79 -40.02 94.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.531 -0.731 . . . . 0.0 109.788 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.05 -48.43 68.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.441 -0.787 . . . . 0.0 110.016 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.8 ttp85 -64.11 -44.55 91.92 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.766 0.793 . . . . 0.0 109.767 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.37 -41.9 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.579 -0.7 . . . . 0.0 109.659 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.656 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 78.3 p -57.9 -40.15 79.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.46 -0.775 . . . . 0.0 109.681 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.17 -44.17 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 109.244 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.72 82.55 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.68 0.752 . . . . 0.0 109.405 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.512 ' SG ' ' N ' ' A' ' 63' ' ' ALA . 1.2 p -66.13 -36.96 84.51 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.821 0.82 . . . . 0.0 109.373 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.512 ' N ' ' SG ' ' A' ' 62' ' ' CYS . . . -60.89 -44.83 96.58 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.528 0.68 . . . . 0.0 109.473 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.96 -42.51 97.26 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.607 0.718 . . . . 0.0 109.513 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.48 -43.18 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.555 -0.716 . . . . 0.0 109.736 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.78 -43.22 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.353 -0.842 . . . . 0.0 109.652 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.4 -44.12 98.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.576 -0.703 . . . . 0.0 109.432 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -67.8 -40.54 83.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.358 -0.838 . . . . 0.0 109.314 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.8 m -63.43 -42.22 98.7 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.619 -0.675 . . . . 0.0 110.098 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.75 -47.34 85.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.251 -0.905 . . . . 0.0 109.811 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.95 -41.45 95.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.523 -0.736 . . . . 0.0 109.412 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 64.4 t0 . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 109.967 -179.568 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.523 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.179 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.2 mt 60.65 0.0 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.712 0.768 . . . . 0.0 109.244 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.523 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.44 -39.71 94.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.481 -0.762 . . . . 0.0 109.458 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -69.87 -19.48 63.43 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.1 mt -94.38 1.29 55.86 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.553 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.672 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.677 0.751 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.75 135.14 54.96 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.879 0.847 . . . . 0.0 109.965 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -88.14 136.79 32.81 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.726 0.774 . . . . 0.0 110.035 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -149.8 125.02 10.1 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.748 0.785 . . . . 0.0 109.569 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.539 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 23.6 mmt85 54.18 25.8 6.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.42 0.628 . . . . 0.0 109.867 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.72 3.62 83.43 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -107.63 141.24 39.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.859 0.837 . . . . 0.0 110.307 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.6 144.85 27.64 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.8 mt -124.0 129.4 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.714 0.769 . . . . 0.0 110.013 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -129.61 96.54 26.76 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.41 159.63 32.57 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.956 2.438 . . . . 0.0 113.118 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.32 126.86 0.94 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.629 ' NE2' ' CD2' ' A' ' 24' ' ' TYR . 0.3 OUTLIER -67.81 140.74 56.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.639 -0.918 . . . . 0.0 109.987 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.596 ' N ' ' ND1' ' A' ' 15' ' ' HIS . 58.6 tt0 -165.18 150.96 9.68 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 121.815 0.817 . . . . 0.0 109.753 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.55 137.67 40.48 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.793 0.806 . . . . 0.0 109.79 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp85 -97.64 135.73 39.03 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.902 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.0 p-10 -71.86 -18.06 62.09 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.93 -42.29 97.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.699 -0.626 . . . . 0.0 109.436 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 pt -113.57 -7.59 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 51.32 51.3 17.16 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.493 0.663 . . . . 0.0 109.608 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -146.48 169.67 18.43 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.932 0.872 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.629 ' CD2' ' NE2' ' A' ' 15' ' ' HIS . 3.2 m-85 -86.51 124.23 32.6 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.746 0.784 . . . . 0.0 109.314 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.45 155.45 39.18 Favored Pre-proline 0 C--N 1.302 -1.464 0 CA-C-O 121.241 0.544 . . . . 0.0 109.713 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.4 ' CB ' ' OG ' ' A' ' 59' ' ' SER . 19.4 Cg_endo -59.33 136.66 73.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.414 2.076 . . . . 0.0 111.726 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -138.52 116.87 11.94 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.409 0.623 . . . . 0.0 109.39 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -133.52 153.99 51.19 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.727 0.775 . . . . 0.0 110.206 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.8 mt -107.94 131.18 54.81 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.732 0.777 . . . . 0.0 109.845 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 89.3 mt -108.85 128.01 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 CA-C-O 121.716 0.77 . . . . 0.0 109.446 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -135.67 134.96 39.73 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.734 0.778 . . . . 0.0 109.836 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -86.83 134.87 33.51 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.751 0.786 . . . . 0.0 109.994 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 78.7 t . . . . . 0 C--N 1.301 -1.538 0 CA-C-O 121.749 0.785 . . . . 0.0 110.503 -179.498 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.24 133.4 21.06 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.445 2.096 . . . . 0.0 112.349 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 35.5 mm -115.9 84.48 13.25 Favored Pre-proline 0 N--CA 1.495 1.803 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -70.32 144.57 51.45 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 122.539 2.159 . . . . 0.0 112.55 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.7 t -105.39 135.27 47.08 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.902 0.858 . . . . 0.0 109.757 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 166.73 22.37 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.701 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.456 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.1 OUTLIER -126.03 146.93 57.4 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -70.62 -12.08 30.71 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 122.628 2.218 . . . . 0.0 111.513 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -78.01 -178.1 5.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.607 -0.683 . . . . 0.0 110.021 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -130.44 147.58 52.16 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.903 0.859 . . . . 0.0 109.984 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -149.34 98.24 2.77 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.615 0.722 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -71.26 -17.3 62.49 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.1 mt -91.27 132.34 36.2 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.807 0.813 . . . . 0.0 109.754 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -67.83 -39.51 83.89 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.8 75.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.683 -0.636 . . . . 0.0 109.927 -179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.84 -38.67 91.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.536 -0.728 . . . . 0.0 109.236 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.92 98.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.754 -0.591 . . . . 0.0 109.419 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -68.14 -47.09 69.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.747 -0.596 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -64.51 -44.05 92.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.604 -0.685 . . . . 0.0 109.665 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.434 HG12 ' SG ' ' A' ' 62' ' ' CYS . 69.7 t -67.76 -40.74 84.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.682 -0.636 . . . . 0.0 109.344 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.4 ' OG ' ' CB ' ' A' ' 26' ' ' PRO . 64.1 m -54.47 -44.81 72.92 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.543 -0.723 . . . . 0.0 109.684 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.596 -0.69 . . . . 0.0 109.375 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.19 95.02 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.767 -0.583 . . . . 0.0 109.757 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.456 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 86.5 m -67.6 -49.4 63.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.515 -0.741 . . . . 0.0 109.602 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.38 15.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.642 -0.661 . . . . 0.0 109.585 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -65.23 -41.22 94.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.735 -0.603 . . . . 0.0 109.445 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.52 -43.75 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.619 -0.676 . . . . 0.0 109.948 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.03 -44.63 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.99 -44.54 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.602 -0.687 . . . . 0.0 109.449 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.539 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 93.0 m-20 -66.32 -43.73 85.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.473 -0.767 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.3 p -65.78 -37.46 86.38 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -58.48 -40.71 83.49 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.2 mt -63.84 -41.44 97.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.735 -0.603 . . . . 0.0 109.422 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 N--CA 1.495 1.787 0 O-C-N 121.652 -0.655 . . . . 0.0 109.742 -179.642 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 86.6 mt -95.83 12.1 31.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.339 -1.095 . . . . 0.0 108.801 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.73 -39.58 94.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.775 -0.578 . . . . 0.0 109.49 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -65.38 -35.72 81.82 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.477 -0.764 . . . . 0.0 109.0 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 87.2 mt -86.22 -5.2 59.24 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.806 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 -179.687 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.313 0.578 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.89 163.71 13.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.109 -0.995 . . . . 0.0 109.528 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -118.65 144.47 46.15 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.677 -0.64 . . . . 0.0 109.471 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -153.04 119.85 5.71 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.276 -0.89 . . . . 0.0 109.713 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 52.28 31.06 8.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.468 -0.77 . . . . 0.0 110.151 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.67 3.32 83.84 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 120.142 -1.028 . . . . 0.0 110.663 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -106.26 136.26 46.3 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.238 -1.154 . . . . 0.0 109.52 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -91.17 145.64 24.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.273 -0.892 . . . . 0.0 108.984 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.1 mt -118.72 128.64 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.684 -0.635 . . . . 0.0 109.709 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -123.8 94.16 46.32 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.08 162.14 32.01 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.868 1.712 . . . . 0.0 112.76 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.533 ' O ' ' ND1' ' A' ' 15' ' ' HIS . . . 179.5 -25.1 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.533 ' ND1' ' O ' ' A' ' 14' ' ' GLY . 0.1 OUTLIER 74.22 155.4 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.532 -0.981 . . . . 0.0 109.723 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -170.44 155.93 5.32 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -105.64 137.12 44.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.362 -0.836 . . . . 0.0 108.788 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -94.26 136.04 34.99 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.149 -0.97 . . . . 0.0 109.722 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 39.8 p30 -68.77 -20.69 64.36 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.478 -0.764 . . . . 0.0 109.552 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.528 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 30.4 t70 -59.29 -49.41 77.96 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.076 -1.015 . . . . 0.0 109.234 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.4 pt -105.71 -4.07 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.453 -0.78 . . . . 0.0 109.571 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 49.0 49.05 20.05 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.69 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -145.6 165.99 27.05 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.299 -0.876 . . . . 0.0 109.593 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -88.54 127.19 35.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.54 -0.725 . . . . 0.0 109.462 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.93 153.31 49.64 Favored Pre-proline 0 N--CA 1.492 1.66 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -43.45 130.97 6.99 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 121.537 1.491 . . . . 0.0 112.096 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -150.99 113.92 4.75 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' O ' HG22 ' A' ' 43' ' ' THR . . . -141.0 163.57 32.61 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.35 -0.844 . . . . 0.0 109.668 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.0 mt -106.26 131.42 53.51 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -115.94 132.26 65.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.618 -0.677 . . . . 0.0 109.89 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -126.02 136.96 53.57 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -96.81 124.38 40.77 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 74.1 t . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.484 -0.76 . . . . 0.0 109.79 179.839 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.02 148.3 44.76 Favored 'Trans proline' 0 C--N 1.314 -1.245 0 C-N-CA 121.391 1.394 . . . . 0.0 111.296 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.4 mm -114.02 132.82 22.5 Favored Pre-proline 0 N--CA 1.498 1.935 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -74.4 150.21 40.95 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 121.752 1.635 . . . . 0.0 112.491 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -128.07 131.63 49.07 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.476 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.0 p -136.55 164.86 27.19 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.632 -0.668 . . . . 0.0 109.422 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 47' ' ' GLU . 77.7 t80 -138.12 121.63 11.39 Favored Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -43.15 82.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.196 1.931 . . . . 0.0 113.288 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 45' ' ' TYR . 47.3 tp10 -168.56 151.57 5.37 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.02 148.56 30.59 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.091 -1.005 . . . . 0.0 111.574 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.47 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 66.7 m-85 -157.05 104.76 2.1 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 25.6 p-10 -74.72 -6.39 48.53 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.177 -0.952 . . . . 0.0 110.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 84.3 mt -102.74 130.32 49.66 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.053 -1.03 . . . . 0.0 110.23 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -66.35 -40.25 89.69 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.472 -0.768 . . . . 0.0 109.279 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -50.88 71.0 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.049 -1.032 . . . . 0.0 109.47 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.47 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.7 t0 -65.47 -39.2 91.7 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.12 -0.988 . . . . 0.0 109.232 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.59 98.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.818 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.31 -43.81 85.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.05 -1.031 . . . . 0.0 109.315 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpp85 -62.53 -46.66 87.39 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.274 -0.891 . . . . 0.0 109.192 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.4 HG23 ' OD1' ' A' ' 54' ' ' ASP . 71.1 t -66.8 -42.62 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.565 -0.71 . . . . 0.0 109.781 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -56.01 -41.48 74.98 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.112 -0.993 . . . . 0.0 109.696 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.97 -44.66 97.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 O-C-N 121.134 -0.979 . . . . 0.0 109.238 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.9 -41.58 82.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.37 -39.79 85.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.302 -0.874 . . . . 0.0 109.786 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.94 -44.84 82.92 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.342 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.87 -42.1 97.6 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.144 -0.973 . . . . 0.0 109.737 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.1 mt -64.06 -43.56 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.175 -0.953 . . . . 0.0 109.629 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' A' ' 66' ' ' ILE . 30.1 mm -63.29 -43.14 98.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.295 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.87 -44.82 99.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 121.173 -0.955 . . . . 0.0 109.4 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -65.78 -45.91 80.69 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.122 -0.986 . . . . 0.0 109.15 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.5 m -62.19 -39.02 91.33 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.428 -0.795 . . . . 0.0 109.75 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.406 ' CE1' ' N ' ' A' ' 79' ' ' ALA . 86.4 t60 -58.93 -50.16 75.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.121 -0.987 . . . . 0.0 110.219 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.52 -43.23 94.69 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.086 -1.009 . . . . 0.0 109.329 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 65.8 t0 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.224 -0.922 . . . . 0.0 110.12 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 mt -94.32 31.79 1.66 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.382 -1.069 . . . . 0.0 109.496 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.406 ' N ' ' CE1' ' A' ' 70' ' ' HIS . . . -61.57 -36.2 79.95 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 0.0 109.748 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.87 -38.15 87.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.119 -0.988 . . . . 0.0 109.401 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.1 mt -83.23 -2.95 56.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.155 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 117.989 -1.451 . . . . 0.0 109.549 179.994 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.92 0.867 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.06 134.19 55.06 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.855 0.836 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -81.97 146.91 29.5 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.701 0.763 . . . . 0.0 110.373 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.64 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 15.8 t80 -154.32 113.95 3.78 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.582 0.706 . . . . 0.0 109.423 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.64 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 46.57 36.1 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.684 0.754 . . . . 0.0 110.184 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.11 -20.08 38.78 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 6' ' ' TYR . 93.4 m-85 -86.76 137.37 32.49 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.379 -1.071 . . . . 0.0 110.122 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -91.99 149.23 21.65 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.466 0.65 . . . . 0.0 109.312 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 90.7 mt -122.82 132.26 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 CA-C-O 121.724 0.773 . . . . 0.0 109.435 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -120.62 88.49 43.35 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.87 147.37 81.77 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.66 2.24 . . . . 0.0 112.375 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.59 -173.72 35.22 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.507 ' CD2' ' OE2' ' A' ' 52' ' ' GLU . 53.7 p-80 -141.08 122.53 15.0 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.759 0.79 . . . . 0.0 109.964 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -154.6 155.33 34.53 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.907 0.86 . . . . 0.0 110.129 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -110.53 145.94 36.88 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.683 0.754 . . . . 0.0 110.071 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.733 ' HE ' HG21 ' A' ' 44' ' ' THR . 95.0 mtt-85 -101.32 137.67 39.35 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.703 0.763 . . . . 0.0 109.756 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -68.46 -15.27 63.49 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.717 -0.614 . . . . 0.0 109.95 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -62.83 -43.26 99.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.375 -0.828 . . . . 0.0 109.362 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.8 pt -114.96 -7.92 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.1 mmm180 55.17 44.11 28.31 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.433 0.635 . . . . 0.0 110.09 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -141.3 161.08 38.74 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.616 0.722 . . . . 0.0 110.49 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.96 128.67 34.73 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.947 0.879 . . . . 0.0 109.85 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.7 m -140.19 149.18 57.27 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -37.04 108.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.315 -1.196 0 C-N-CA 122.939 2.426 . . . . 0.0 112.387 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -104.78 119.89 40.07 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.669 0.747 . . . . 0.0 109.957 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.485 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -144.86 147.64 33.04 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.835 0.826 . . . . 0.0 109.577 179.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.8 mt -109.62 133.83 52.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.621 0.724 . . . . 0.0 109.199 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 mm -103.18 123.05 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -127.94 137.31 52.22 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.9 0.857 . . . . 0.0 110.22 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -101.89 141.56 34.56 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.899 0.857 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.8 t . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 121.952 0.882 . . . . 0.0 110.637 -179.128 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -57.92 145.34 91.56 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.487 2.125 . . . . 0.0 112.515 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.543 ' N ' HD12 ' A' ' 41' ' ' ILE . 0.9 OUTLIER -127.32 89.26 51.99 Favored Pre-proline 0 N--CA 1.493 1.676 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.788 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.39 143.05 56.08 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.702 2.268 . . . . 0.0 112.833 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.485 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 14.8 t -105.32 134.83 47.77 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.821 0.819 . . . . 0.0 109.831 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.733 HG21 ' HE ' ' A' ' 18' ' ' ARG . 47.0 p -141.2 167.26 22.61 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.54 0.686 . . . . 0.0 109.871 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.578 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.5 OUTLIER -128.44 146.49 60.07 Favored Pre-proline 0 N--CA 1.486 1.367 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -48.99 -37.18 36.71 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 122.058 1.839 . . . . 0.0 111.271 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -45.55 150.55 0.48 Allowed 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.798 0.808 . . . . 0.0 110.15 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -121.85 139.6 53.42 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.822 0.82 . . . . 0.0 110.045 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.417 ' CE2' HG21 ' A' ' 58' ' ' VAL . 67.7 m-85 -141.66 111.93 6.92 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.686 0.755 . . . . 0.0 109.341 179.136 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.49 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 20.1 p-10 -68.32 -33.08 73.66 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.271 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.76 136.68 39.02 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.014 0.911 . . . . 0.0 109.942 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.507 ' OE2' ' CD2' ' A' ' 15' ' ' HIS . 43.6 tt0 -70.71 -37.07 73.52 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.765 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.71 -39.19 93.28 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.556 -0.715 . . . . 0.0 110.326 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -65.16 -38.97 92.25 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.45 -0.781 . . . . 0.0 109.362 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.91 89.19 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.614 -0.679 . . . . 0.0 109.819 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -66.85 -47.64 71.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.472 -0.768 . . . . 0.0 109.768 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -66.17 -44.1 85.03 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 121.47 0.652 . . . . 0.0 109.865 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.417 HG21 ' CE2' ' A' ' 49' ' ' TYR . 75.5 t -66.98 -41.28 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 109.575 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.0 p -57.87 -39.47 77.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.573 -0.704 . . . . 0.0 109.715 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.0 -45.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.62 -39.18 77.34 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.497 0.665 . . . . 0.0 109.764 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.578 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 5.9 t -70.92 -37.36 72.9 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.478 -0.764 . . . . 0.0 109.662 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.86 87.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.69 -0.631 . . . . 0.0 109.711 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -64.02 -42.93 96.96 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.563 0.697 . . . . 0.0 109.293 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.3 mt -65.36 -43.51 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.647 -0.658 . . . . 0.0 109.642 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -64.22 -44.18 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 110.104 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.2 mt -65.1 -43.68 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.642 -0.661 . . . . 0.0 109.306 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -66.24 -43.65 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.628 -0.67 . . . . 0.0 109.456 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.0 p -68.27 -36.66 79.74 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.56 0.695 . . . . 0.0 109.435 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -61.27 -45.29 95.1 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.628 -0.67 . . . . 0.0 109.76 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 81.3 mt -64.65 -42.91 95.09 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.468 0.651 . . . . 0.0 109.639 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.97 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.98 25.96 10.72 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.716 -0.873 . . . . 0.0 109.64 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.12 79.55 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.353 -0.842 . . . . 0.0 109.426 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.466 ' HB2' HD11 ' A' ' 41' ' ' ILE . 99.7 m-20 -62.5 -40.81 97.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.445 0.64 . . . . 0.0 109.64 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -84.84 -2.56 57.91 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -179.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.839 0.828 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.44 155.34 17.92 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.546 -0.721 . . . . 0.0 109.509 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -109.52 141.39 42.05 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.71 0.767 . . . . 0.0 109.947 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -153.69 122.59 6.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.41 -0.806 . . . . 0.0 109.21 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 54.83 25.91 7.17 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.634 0.73 . . . . 0.0 110.083 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.48 8.37 77.55 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -110.84 142.94 42.18 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.349 -1.089 . . . . 0.0 110.292 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -91.91 142.34 27.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.407 -0.808 . . . . 0.0 109.438 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.13 130.62 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.511 -0.743 . . . . 0.0 109.591 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -120.83 94.22 48.87 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -78.26 148.6 24.2 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.608 2.205 . . . . 0.0 113.101 -178.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.78 115.04 0.39 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -55.18 136.91 48.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -1.038 . . . . 0.0 111.034 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -153.59 149.29 27.46 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.467 -0.771 . . . . 0.0 109.32 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -106.78 134.32 50.11 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.858 0.837 . . . . 0.0 110.119 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 94.2 mtt180 -94.13 138.19 32.47 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.538 -0.726 . . . . 0.0 109.786 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -68.66 -20.74 64.47 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.531 -0.731 . . . . 0.0 109.434 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.83 -43.68 95.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.904 . . . . 0.0 109.784 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 15.1 pt -112.12 -0.31 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' ARG . 90.2 mtm-85 43.28 37.2 1.22 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.64 -0.662 . . . . 0.0 110.401 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -137.48 162.56 33.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.253 -0.905 . . . . 0.0 110.172 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -86.12 128.57 34.9 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.843 0.83 . . . . 0.0 109.85 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.5 m -145.84 147.63 33.16 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -37.27 110.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.707 2.272 . . . . 0.0 112.17 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -119.58 118.42 30.96 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.38 -0.825 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.1 155.0 44.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.312 -0.868 . . . . 0.0 109.179 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -111.08 130.28 55.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.731 . . . . 0.0 109.254 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 98.1 mt -107.11 130.65 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -134.81 138.51 44.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.501 -0.75 . . . . 0.0 109.048 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.53 137.48 32.3 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -0.812 . . . . 0.0 110.196 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 76.7 t . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 121.692 0.758 . . . . 0.0 110.39 -179.698 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.6 m . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -55.19 140.46 81.08 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.763 2.309 . . . . 0.0 112.035 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.88 131.05 24.04 Favored Pre-proline 0 N--CA 1.495 1.777 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.81 142.78 44.11 Favored 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.132 1.888 . . . . 0.0 112.494 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.8 t -119.22 130.22 55.36 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.642 0.734 . . . . 0.0 109.089 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -139.22 167.45 22.05 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.553 ' O ' ' N ' ' A' ' 47' ' ' GLU . 82.6 t80 -120.62 123.8 27.89 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.596 -0.69 . . . . 0.0 109.193 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -43.35 80.54 0.01 OUTLIER 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 122.576 2.184 . . . . 0.0 112.561 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 45' ' ' TYR . 81.2 tt0 -172.69 157.76 3.88 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.266 -0.896 . . . . 0.0 109.028 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -112.09 140.08 47.07 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.361 -0.837 . . . . 0.0 109.486 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.475 ' CZ ' ' OE2' ' A' ' 47' ' ' GLU . 37.7 m-85 -135.7 131.56 35.79 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.38 -0.825 . . . . 0.0 108.9 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -93.32 -23.95 18.3 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.83 137.76 32.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.068 -1.02 . . . . 0.0 110.181 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -71.13 -37.51 72.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.48 -0.762 . . . . 0.0 109.398 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.49 84.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 109.421 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.7 -41.46 98.12 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.405 -0.81 . . . . 0.0 109.506 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.2 96.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 109.981 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.85 -44.25 70.24 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.118 -0.989 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -67.68 -43.01 81.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.162 -0.961 . . . . 0.0 110.027 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.92 -42.68 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.709 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -60.35 -42.15 95.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.623 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 93.7 mt -65.52 -44.47 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.147 -0.971 . . . . 0.0 109.691 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.71 -39.3 80.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.053 -1.03 . . . . 0.0 109.211 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.8 t -69.54 -38.37 77.48 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.406 -0.809 . . . . 0.0 109.625 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.9 -46.13 85.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.48 -43.82 96.21 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.118 -0.989 . . . . 0.0 109.455 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.57 -43.06 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.908 . . . . 0.0 109.394 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.44 -44.05 98.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.177 -0.952 . . . . 0.0 109.586 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.02 -44.48 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.216 -0.928 . . . . 0.0 109.447 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -66.4 -41.98 88.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.431 -0.793 . . . . 0.0 109.878 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.8 p -67.63 -35.73 79.47 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.237 -0.914 . . . . 0.0 109.692 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.476 ' CD2' ' H ' ' A' ' 78' ' ' LEU . 54.4 t-80 -60.64 -43.86 97.08 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.334 -0.854 . . . . 0.0 109.61 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.87 -41.78 97.69 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.863 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.17 -0.956 . . . . 0.0 110.24 -179.45 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.59 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.476 ' H ' ' CD2' ' A' ' 70' ' ' HIS . 25.1 mt -108.36 24.85 12.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.466 -1.02 . . . . 0.0 109.476 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.86 89.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -64.58 -35.63 81.62 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.306 -0.871 . . . . 0.0 109.485 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 85.1 mt -83.27 14.74 3.33 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.217 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.517 0.675 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.8 157.35 16.18 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -0.842 . . . . 0.0 109.978 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.22 143.43 41.99 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.67 -0.644 . . . . 0.0 109.528 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -155.47 126.3 6.99 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.435 -0.791 . . . . 0.0 109.448 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.427 HH21 HD13 ' A' ' 71' ' ' LEU . 22.1 mmm180 53.22 24.75 3.88 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.705 0.764 . . . . 0.0 109.615 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 33' ' ' VAL . . . 89.63 -16.67 55.89 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -84.9 143.17 29.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -1.102 . . . . 0.0 110.49 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -90.12 143.94 26.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.468 -0.77 . . . . 0.0 109.063 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.5 mt -124.3 129.9 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.611 -0.68 . . . . 0.0 109.275 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.497 ' O ' ' HB1' ' A' ' 28' ' ' ALA . 31.7 mt-10 -115.5 126.34 27.85 Favored Pre-proline 0 N--CA 1.492 1.663 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.93 158.45 38.54 Favored 'Trans proline' 0 N--CA 1.495 1.588 0 C-N-CA 122.351 2.034 . . . . 0.0 113.098 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.3 -176.6 45.26 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -147.79 124.53 11.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.347 -1.09 . . . . 0.0 109.015 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -146.12 157.46 43.84 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.924 . . . . 0.0 109.06 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -106.5 145.9 31.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.624 -0.672 . . . . 0.0 110.175 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.422 HH21 ' CD1' ' A' ' 21' ' ' ILE . 88.9 mtm180 -92.87 140.03 29.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.459 -0.776 . . . . 0.0 110.117 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -67.44 -28.46 67.91 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.396 -0.815 . . . . 0.0 109.534 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -60.26 -49.02 79.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.463 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.422 ' CD1' HH21 ' A' ' 18' ' ' ARG . 18.7 pt -106.29 0.03 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.493 -0.755 . . . . 0.0 109.502 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 43.19 44.71 4.55 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.413 -0.805 . . . . 0.0 109.833 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -137.92 161.41 36.72 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.397 -0.814 . . . . 0.0 110.081 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -84.32 133.41 34.54 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.572 0.701 . . . . 0.0 110.171 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.6 155.25 41.77 Favored Pre-proline 0 N--CA 1.487 1.395 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -42.42 120.47 1.68 Allowed 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 122.167 1.911 . . . . 0.0 111.9 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -126.18 127.98 46.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.704 -0.623 . . . . 0.0 109.747 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -150.99 157.69 43.19 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.307 -0.871 . . . . 0.0 109.2 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 86.0 mt -106.63 135.34 48.32 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -117.35 132.03 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.82 -0.55 . . . . 0.0 109.809 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -131.84 138.6 48.55 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.5 0.667 . . . . 0.0 109.403 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -83.48 135.97 34.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.513 -0.742 . . . . 0.0 110.058 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 8' ' ' GLY . 91.3 t . . . . . 0 N--CA 1.489 1.485 0 O-C-N 121.421 -0.8 . . . . 0.0 110.045 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.42 ' O ' ' OD2' ' A' ' 80' ' ' ASP . 9.8 m . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.05 146.05 28.63 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 121.957 1.771 . . . . 0.0 112.52 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.413 HD11 ' OD2' ' A' ' 80' ' ' ASP . 31.7 mm -115.07 93.74 36.11 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.25 140.64 51.54 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.13 1.887 . . . . 0.0 112.068 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 t -99.03 136.14 39.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.422 -0.799 . . . . 0.0 109.631 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -132.47 161.06 34.69 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.541 ' O ' ' O ' ' A' ' 46' ' ' PRO . 4.4 t80 -142.03 140.62 19.87 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 45' ' ' TYR . 76.7 Cg_exo -46.24 -131.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.974 2.449 . . . . 0.0 113.39 178.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' PRO . 58.8 mp0 44.29 -170.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.097 -1.002 . . . . 0.0 110.468 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 49' ' ' TYR . 71.2 m-85 -145.7 149.3 34.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.145 -0.972 . . . . 0.0 109.8 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.413 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 64.1 m-85 -146.9 105.94 3.87 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.475 -0.766 . . . . 0.0 109.133 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -72.65 -17.59 61.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.4 mt -96.53 126.73 41.92 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.81 0.814 . . . . 0.0 109.92 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -69.37 -38.06 77.87 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.457 0.646 . . . . 0.0 109.811 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -46.63 87.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.369 -0.832 . . . . 0.0 109.745 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -65.2 -36.03 82.9 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.486 -0.759 . . . . 0.0 109.475 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.33 -38.74 92.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.315 -0.866 . . . . 0.0 109.433 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.77 -48.07 78.41 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.883 . . . . 0.0 109.594 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -46.1 89.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 109.289 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.8 t -64.0 -42.69 96.5 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.729 -0.607 . . . . 0.0 109.524 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.477 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 45.6 m -55.25 -39.94 70.36 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.079 -1.013 . . . . 0.0 109.566 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.499 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.2 mt -64.03 -44.99 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 120.96 -1.088 . . . . 0.0 109.098 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.92 79.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.9 . . . . 0.0 109.737 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.5 m -66.75 -38.29 86.32 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.286 -0.884 . . . . 0.0 109.172 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.8 -43.57 77.0 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.405 -0.809 . . . . 0.0 109.212 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.499 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 33.5 mtmm -62.84 -42.17 99.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.105 -0.997 . . . . 0.0 109.532 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.07 -43.44 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.43 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.63 -43.57 98.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.297 -0.877 . . . . 0.0 109.591 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.23 -45.15 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.035 -1.04 . . . . 0.0 109.557 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.83 -41.69 97.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 t -65.95 -37.91 87.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.289 -0.882 . . . . 0.0 109.425 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.65 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 81.7 t60 -56.39 -45.12 80.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.217 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.427 HD13 HH21 ' A' ' 7' ' ' ARG . 64.9 mt -65.13 -38.48 90.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.363 -0.836 . . . . 0.0 109.543 179.347 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 63.5 t0 . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.884 -179.485 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.474 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.65 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 42.8 mt -111.01 31.77 5.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.48 -1.011 . . . . 0.0 109.462 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.44 -36.67 84.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.902 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.42 ' OD2' ' O ' ' A' ' 39' ' ' THR . 21.3 p-10 -59.6 -45.84 90.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 109.893 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.52 -41.45 96.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 0.0 110.197 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 CA-C-O 117.87 -1.517 . . . . 0.0 109.574 -179.642 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.849 0.833 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.43 160.33 14.85 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.67 0.747 . . . . 0.0 110.094 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -108.0 147.17 31.47 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.778 0.799 . . . . 0.0 109.812 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -151.71 119.11 5.99 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.864 0.84 . . . . 0.0 110.051 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.434 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.7 mtp180 45.85 32.09 1.21 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.441 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.22 -23.03 35.33 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -84.03 141.47 31.15 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.516 -0.99 . . . . 0.0 110.317 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -94.3 140.08 30.25 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.742 0.782 . . . . 0.0 109.697 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -116.75 128.89 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.678 0.752 . . . . 0.0 109.719 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -123.97 96.49 42.46 Favored Pre-proline 0 N--CA 1.492 1.645 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.13 154.7 37.47 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 122.874 2.383 . . . . 0.0 112.689 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.8 95.75 0.11 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -47.43 146.74 1.93 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.791 -0.829 . . . . 0.0 109.919 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -146.98 157.99 43.79 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.872 0.844 . . . . 0.0 109.799 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -101.34 119.94 39.52 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.733 0.777 . . . . 0.0 109.615 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -95.78 137.86 34.25 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.828 0.823 . . . . 0.0 110.001 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.94 -24.3 41.12 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -62.6 -44.81 95.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.59 -0.693 . . . . 0.0 109.626 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.3 pt -106.98 1.27 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.46 -0.775 . . . . 0.0 109.279 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 42.95 39.59 1.83 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.594 0.711 . . . . 0.0 109.689 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HG3' ' H ' ' A' ' 24' ' ' TYR . 29.4 tptt -145.88 161.46 39.96 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.774 0.797 . . . . 0.0 110.21 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.402 ' H ' ' HG3' ' A' ' 23' ' ' LYS . 95.7 m-85 -85.96 132.7 34.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.916 0.865 . . . . 0.0 109.449 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.6 m -148.1 148.44 29.55 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.796 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.47 110.42 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.745 2.296 . . . . 0.0 111.868 178.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.8 121.44 40.8 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.812 0.815 . . . . 0.0 109.837 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.53 ' O ' HG22 ' A' ' 43' ' ' THR . . . -143.03 154.11 43.65 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.692 0.758 . . . . 0.0 109.995 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.4 mt -111.4 129.43 56.02 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.695 0.759 . . . . 0.0 109.321 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -108.81 130.22 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.712 0.768 . . . . 0.0 109.813 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -130.57 130.83 44.56 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.847 0.832 . . . . 0.0 109.704 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -84.76 135.87 33.94 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.841 0.829 . . . . 0.0 109.837 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 73.1 t . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 121.754 0.788 . . . . 0.0 110.124 -179.781 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.484 1.255 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 147.32 34.2 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.367 2.045 . . . . 0.0 112.531 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -114.23 126.49 27.93 Favored Pre-proline 0 N--CA 1.487 1.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -74.99 145.54 31.62 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 C-N-CA 122.427 2.085 . . . . 0.0 112.333 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER -122.87 130.73 53.23 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.866 0.841 . . . . 0.0 109.575 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.9 p -141.07 167.42 22.24 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.713 0.768 . . . . 0.0 109.568 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.504 ' O ' ' N ' ' A' ' 47' ' ' GLU . 55.3 t80 -123.88 126.84 25.59 Favored Pre-proline 0 N--CA 1.488 1.448 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -46.28 83.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 122.446 2.097 . . . . 0.0 112.251 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 45' ' ' TYR . 45.2 tp10 -170.79 147.6 2.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 109.374 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -109.88 127.52 54.77 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.607 0.718 . . . . 0.0 109.686 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.05 133.5 54.32 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.979 0.895 . . . . 0.0 109.778 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -87.09 -24.31 24.61 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -103.72 132.53 49.89 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.974 0.892 . . . . 0.0 109.732 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.654 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 1.1 pm0 -68.83 -34.86 76.19 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.39 -47.68 72.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.667 -0.646 . . . . 0.0 109.323 -179.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.412 ' O ' HG23 ' A' ' 58' ' ' VAL . 54.4 m-20 -65.21 -37.58 87.73 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.575 -0.703 . . . . 0.0 109.371 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -36.45 82.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.735 -0.603 . . . . 0.0 109.566 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.61 -51.42 67.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.708 -0.62 . . . . 0.0 109.616 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -63.66 -43.47 96.63 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.393 0.616 . . . . 0.0 109.53 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 54' ' ' ASP . 72.5 t -64.96 -39.61 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.3 m -55.89 -43.14 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.578 -0.701 . . . . 0.0 109.519 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.18 -45.88 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.602 -0.686 . . . . 0.0 109.593 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.87 -36.82 80.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.545 -0.722 . . . . 0.0 109.293 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -65.8 -49.44 68.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.647 -0.658 . . . . 0.0 109.732 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.44 -39.77 64.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.736 -0.602 . . . . 0.0 109.661 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -39.82 94.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.71 -0.619 . . . . 0.0 109.688 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.68 -43.97 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.67 -0.644 . . . . 0.0 109.855 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.36 -43.54 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.528 -0.732 . . . . 0.0 109.462 -179.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.2 mt -63.7 -44.71 98.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.434 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 97.2 m-20 -69.99 -44.77 68.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.429 0.633 . . . . 0.0 109.77 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.1 t -65.7 -42.02 91.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.666 -0.646 . . . . 0.0 109.781 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -59.24 -44.75 92.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.641 -0.662 . . . . 0.0 109.468 -179.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.2 -43.08 96.15 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.645 -0.66 . . . . 0.0 110.025 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.497 -0.752 . . . . 0.0 109.062 179.957 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.521 0 N-CA-C 108.934 -1.667 . . . . 0.0 108.934 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.5 mt -100.35 21.34 13.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.581 -0.952 . . . . 0.0 108.456 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.34 98.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.931 -0.48 . . . . 0.0 109.944 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.86 -35.83 81.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.682 -0.636 . . . . 0.0 109.547 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.2 mt -85.1 -6.26 59.31 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 109.5 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.675 0 CA-C-O 117.952 -1.471 . . . . 0.0 109.729 -179.774 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 121.301 0.572 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.86 133.28 53.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.563 -0.711 . . . . 0.0 109.525 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -83.34 135.17 34.82 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.413 -0.804 . . . . 0.0 109.971 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -144.0 117.86 9.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.347 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.449 ' HE ' ' CD1' ' A' ' 71' ' ' LEU . 78.5 mtp85 53.85 29.15 9.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.551 -0.718 . . . . 0.0 109.758 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.09 -4.56 83.04 Favored Glycine 0 N--CA 1.494 2.531 0 N-CA-C 110.199 -1.161 . . . . 0.0 110.199 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -105.89 134.44 49.02 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.456 -1.026 . . . . 0.0 109.935 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.89 144.6 25.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 109.091 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 78.8 mt -120.19 136.45 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.249 0.547 . . . . 0.0 109.628 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -121.56 85.61 43.71 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -61.48 150.22 86.17 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.858 2.372 . . . . 0.0 112.536 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.566 ' O ' ' CG ' ' A' ' 15' ' ' HIS . . . -174.01 -9.1 0.02 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.566 ' CG ' ' O ' ' A' ' 14' ' ' GLY . 3.9 p-80 56.57 153.34 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.785 -0.832 . . . . 0.0 110.571 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -169.24 153.11 5.23 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.494 -0.754 . . . . 0.0 109.059 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -98.99 137.49 37.45 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.537 -0.727 . . . . 0.0 109.649 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -92.19 135.95 33.58 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.582 -0.699 . . . . 0.0 109.593 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.47 -19.95 63.75 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.51 -0.744 . . . . 0.0 109.504 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -62.95 -44.65 95.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.477 -0.765 . . . . 0.0 109.88 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.2 pt -109.71 2.76 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.666 -0.646 . . . . 0.0 109.289 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 43.44 43.05 4.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.626 -0.672 . . . . 0.0 109.438 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.8 tptm -139.39 164.46 29.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.409 -0.807 . . . . 0.0 109.732 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -85.1 129.97 34.7 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.734 -0.604 . . . . 0.0 109.765 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' H ' ' A' ' 48' ' ' PHE . 0.5 OUTLIER -150.17 155.17 37.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.378 -0.826 . . . . 0.0 108.998 179.512 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -43.47 135.83 6.41 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.198 1.932 . . . . 0.0 112.693 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE2' ' CB ' ' A' ' 42' ' ' PRO . 48.7 t80 -153.5 114.47 4.1 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.39 152.35 49.55 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.388 -0.82 . . . . 0.0 109.706 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.05 129.62 44.89 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.4 mt -115.83 131.41 68.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.627 -0.671 . . . . 0.0 110.035 -179.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -132.9 145.74 51.19 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.586 -0.696 . . . . 0.0 109.21 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -82.62 128.23 34.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.211 -0.93 . . . . 0.0 109.797 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.4 t . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.566 -0.709 . . . . 0.0 110.165 -179.684 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.541 ' O ' HD21 ' A' ' 81' ' ' LEU . 45.9 m . . . . . 0 N--CA 1.496 1.85 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -75.45 146.86 31.58 Favored 'Trans proline' 0 N--CA 1.493 1.499 0 C-N-CA 122.197 1.932 . . . . 0.0 113.024 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.407 HD12 ' O ' ' A' ' 39' ' ' THR . 4.5 mp -134.35 90.69 24.21 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.479 ' CB ' ' CE2' ' A' ' 27' ' ' TYR . 48.3 Cg_exo -54.72 144.75 63.7 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.319 2.013 . . . . 0.0 111.87 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 t -99.67 136.14 40.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.581 -0.699 . . . . 0.0 109.227 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -136.56 157.52 46.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -139.31 101.35 7.54 Favored Pre-proline 0 N--CA 1.492 1.64 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.2 107.14 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 121.825 1.683 . . . . 0.0 112.475 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 48' ' ' PHE . 54.6 mt-10 -150.66 -13.13 0.24 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.482 ' H ' HG12 ' A' ' 25' ' ' VAL . 1.6 m-85 54.24 108.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.238 0.542 . . . . 0.0 110.1 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -131.54 132.86 44.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.582 -0.699 . . . . 0.0 109.417 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -87.24 -22.11 25.41 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.736 . . . . 0.0 109.316 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -91.12 133.08 35.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.466 -0.771 . . . . 0.0 110.659 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -67.62 -38.02 83.33 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.55 -40.45 91.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 109.759 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 58' ' ' VAL . 99.5 m-20 -62.75 -43.3 99.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.433 -0.792 . . . . 0.0 109.817 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.48 96.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.453 -0.78 . . . . 0.0 110.034 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -66.91 -49.44 65.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.401 -0.812 . . . . 0.0 109.911 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -65.99 -43.65 87.18 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.514 -0.741 . . . . 0.0 109.653 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 54' ' ' ASP . 67.6 t -65.11 -42.65 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.603 -0.686 . . . . 0.0 109.532 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -58.09 -42.23 85.18 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.458 -0.777 . . . . 0.0 109.87 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.421 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.4 mt -64.81 -44.85 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.139 -0.975 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.06 -44.36 80.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.502 -0.749 . . . . 0.0 109.485 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.1 m -65.86 -43.62 87.83 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.583 -0.698 . . . . 0.0 109.265 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -50.17 -42.91 51.96 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.421 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 64.2 mttp -63.31 -43.01 99.03 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.489 -0.757 . . . . 0.0 109.302 179.445 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.12 -44.75 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.375 -0.828 . . . . 0.0 109.774 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -66.04 -45.93 89.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.376 -0.828 . . . . 0.0 109.138 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.8 mt -64.75 -44.65 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.485 -0.759 . . . . 0.0 109.629 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -68.52 -46.35 69.8 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.538 -0.727 . . . . 0.0 109.87 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.6 m -62.63 -42.15 99.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.568 -0.708 . . . . 0.0 110.094 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -59.16 -42.34 90.51 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.754 . . . . 0.0 109.674 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.449 ' CD1' ' HE ' ' A' ' 7' ' ' ARG . 81.9 mt -64.88 -36.0 82.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.588 -0.695 . . . . 0.0 109.719 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.854 . . . . 0.0 109.626 -179.534 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.6 mt -101.91 17.87 22.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.536 -0.979 . . . . 0.0 109.521 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.93 -38.68 89.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.393 -0.817 . . . . 0.0 109.48 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.85 -37.28 86.79 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.524 -0.735 . . . . 0.0 109.835 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.541 HD21 ' O ' ' A' ' 39' ' ' THR . 54.2 mt -83.38 -3.14 57.24 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.354 -0.841 . . . . 0.0 109.121 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.3 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -76.67 151.94 35.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.486 -0.759 . . . . 0.0 110.13 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m -72.37 140.62 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.604 -0.685 . . . . 0.0 109.887 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.76 140.62 32.68 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.267 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -83.19 149.85 26.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.0 110.267 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.406 ' N ' ' O ' ' A' ' 9' ' ' TYR . 88.1 t80 -153.54 115.04 4.2 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.409 -0.807 . . . . 0.0 109.327 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.488 HH12 ' CD1' ' A' ' 71' ' ' LEU . 20.7 mtp-105 52.07 30.18 7.22 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 109.921 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.68 -1.87 81.82 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.406 ' O ' ' N ' ' A' ' 6' ' ' TYR . 95.4 m-85 -106.73 141.93 37.19 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.373 -1.075 . . . . 0.0 109.761 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -89.72 146.1 24.74 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.524 -0.735 . . . . 0.0 109.491 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -121.59 136.52 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' ' H ' ' A' ' 29' ' ' LEU . 21.7 tt0 -119.18 87.68 35.46 Favored Pre-proline 0 N--CA 1.496 1.857 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.11 146.05 95.68 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.524 2.149 . . . . 0.0 112.204 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.54 -167.72 39.37 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -148.48 142.9 26.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.283 -1.127 . . . . 0.0 109.535 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -161.85 150.57 15.48 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -109.09 143.5 38.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.476 -0.765 . . . . 0.0 109.66 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.438 ' NH2' HG21 ' A' ' 44' ' ' THR . 86.2 mtt180 -99.47 139.11 35.61 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 121.529 0.68 . . . . 0.0 109.83 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.26 -20.24 64.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.442 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.92 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.154 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.5 pt -109.63 0.02 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 42.12 39.64 1.44 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.785 -0.572 . . . . 0.0 109.868 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -140.5 161.45 37.7 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.285 -0.885 . . . . 0.0 109.825 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -85.73 130.86 34.45 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.429 0.633 . . . . 0.0 109.854 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.98 146.85 32.58 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.45 -0.781 . . . . 0.0 109.338 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -37.72 111.55 0.1 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 122.571 2.181 . . . . 0.0 112.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -121.57 117.33 26.5 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -142.15 159.0 43.11 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.193 -0.942 . . . . 0.0 109.592 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.431 ' H ' ' HB3' ' A' ' 12' ' ' GLU . 53.8 mt -113.6 134.47 54.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.638 -0.664 . . . . 0.0 109.238 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.9 mt -111.92 133.1 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.681 -0.637 . . . . 0.0 109.53 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -127.32 130.63 49.84 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -83.4 138.64 33.41 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.646 0.736 . . . . 0.0 110.326 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.5 t -64.44 -42.51 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.718 -0.614 . . . . 0.0 109.939 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.82 -36.39 93.24 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.635 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.1 m -150.54 73.17 9.0 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 120.855 -1.379 . . . . 0.0 109.795 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -77.47 -9.61 17.4 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.405 2.07 . . . . 0.0 111.125 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -76.0 -6.29 50.3 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.578 -0.701 . . . . 0.0 109.128 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -78.68 147.46 33.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.394 -0.817 . . . . 0.0 109.965 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.8 m -44.9 131.15 5.27 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.25 151.92 44.11 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.887 1.725 . . . . 0.0 111.882 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.489 HD11 ' OD2' ' A' ' 80' ' ' ASP . 38.6 mm -115.48 100.21 53.33 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.57 136.2 41.13 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 121.897 1.731 . . . . 0.0 112.483 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 p -95.27 134.97 37.45 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.438 HG21 ' NH2' ' A' ' 18' ' ' ARG . 54.7 p -138.01 167.16 22.36 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -148.89 141.68 15.42 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.178 -0.951 . . . . 0.0 108.929 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.56 86.33 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.88 1.72 . . . . 0.0 112.226 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -176.4 169.5 2.66 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.499 -0.751 . . . . 0.0 108.98 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -130.7 146.91 52.3 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.418 -0.801 . . . . 0.0 109.413 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.505 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 27.9 m-85 -141.81 123.46 15.1 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.356 -0.84 . . . . 0.0 109.589 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.16 -33.25 67.57 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.355 0.598 . . . . 0.0 109.701 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -89.45 133.12 34.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.805 . . . . 0.0 110.538 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -69.57 -36.04 75.91 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.452 0.644 . . . . 0.0 109.476 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.58 91.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.506 -0.746 . . . . 0.0 109.515 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.505 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 58.0 t0 -63.09 -38.01 89.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.378 -0.826 . . . . 0.0 109.051 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.41 -36.64 84.81 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.493 -0.754 . . . . 0.0 109.639 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.53 -49.48 75.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 109.731 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.63 -42.77 95.27 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.272 -0.892 . . . . 0.0 109.444 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.5 t -65.22 -42.78 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.564 -0.71 . . . . 0.0 109.631 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 98.1 p -56.62 -39.39 73.55 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.411 -0.805 . . . . 0.0 109.676 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.84 -45.29 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 109.296 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.71 82.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.339 -0.851 . . . . 0.0 109.423 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.56 -46.15 76.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.468 -0.77 . . . . 0.0 109.5 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.13 73.99 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.369 -0.832 . . . . 0.0 109.452 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.42 -43.96 95.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.301 -0.874 . . . . 0.0 109.365 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.37 -44.38 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.433 -0.792 . . . . 0.0 110.104 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 32.7 mm -64.17 -44.38 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.157 -0.964 . . . . 0.0 109.404 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 94.7 mt -64.38 -45.66 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.159 -0.963 . . . . 0.0 109.506 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.28 -46.36 77.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.338 -0.852 . . . . 0.0 109.635 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.486 ' O ' ' N ' ' A' ' 73' ' ' ARG . 19.2 m -63.15 -37.91 89.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.546 -0.721 . . . . 0.0 109.85 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -59.78 -47.9 83.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.631 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.488 ' CD1' HH12 ' A' ' 7' ' ' ARG . 90.6 mt -64.18 -42.8 96.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.348 -0.845 . . . . 0.0 109.871 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -83.37 -67.59 0.78 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.319 -0.863 . . . . 0.0 110.33 -179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.486 ' N ' ' O ' ' A' ' 69' ' ' SER . 80.7 mtp85 -84.43 142.91 29.77 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.383 -0.823 . . . . 0.0 110.213 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.75 66.88 9.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.563 -0.71 . . . . 0.0 109.087 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -79.58 -3.11 45.51 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? 54.31 93.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.548 0.69 . . . . 0.0 109.892 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -152.87 -65.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.18 30.55 1.23 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.275 -1.133 . . . . 0.0 109.305 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.15 -35.81 81.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.648 -0.658 . . . . 0.0 109.308 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.489 ' OD2' HD11 ' A' ' 41' ' ' ILE . 23.1 p-10 -64.69 -31.88 73.3 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.481 -0.762 . . . . 0.0 109.625 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.35 -3.29 57.36 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.326 -0.859 . . . . 0.0 109.471 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.68 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.467 0.651 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -88.14 110.71 20.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.378 -0.827 . . . . 0.0 109.607 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.2 m -84.75 150.83 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 109.98 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.28 140.82 47.67 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.575 -0.703 . . . . 0.0 109.433 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.9 m170 -85.13 154.13 22.23 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.401 -0.812 . . . . 0.0 110.307 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.615 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 20.6 t80 -153.3 111.43 3.62 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.328 -0.857 . . . . 0.0 109.044 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.615 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 47.41 31.86 2.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.539 -0.726 . . . . 0.0 110.102 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.34 -20.74 47.98 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -85.4 138.42 32.27 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -1.067 . . . . 0.0 110.107 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.31 139.13 31.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.626 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.0 mt -121.29 130.42 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -121.93 87.94 47.31 Favored Pre-proline 0 N--CA 1.496 1.837 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -57.82 144.97 92.56 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 122.697 2.264 . . . . 0.0 112.506 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.91 98.19 0.11 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -49.01 155.82 0.58 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.434 -1.039 . . . . 0.0 110.793 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -154.87 157.87 38.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.39 -0.819 . . . . 0.0 109.051 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -99.96 120.66 40.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.593 -0.692 . . . . 0.0 109.396 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.483 ' NH1' ' OG1' ' A' ' 44' ' ' THR . 84.4 mtp180 -102.04 138.58 38.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.601 -0.687 . . . . 0.0 109.964 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.22 -17.03 58.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.554 -0.716 . . . . 0.0 109.404 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -59.64 -49.54 77.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.222 -0.924 . . . . 0.0 109.652 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.444 HG13 ' H ' ' A' ' 23' ' ' LYS . 41.1 pt -107.9 0.27 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 50.33 34.93 9.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.643 -0.661 . . . . 0.0 109.582 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.444 ' H ' HG13 ' A' ' 21' ' ' ILE . 56.0 mmtt -140.44 174.42 10.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.366 -0.834 . . . . 0.0 110.217 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -93.72 130.29 39.74 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.534 0.683 . . . . 0.0 109.954 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' O ' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -143.17 155.63 61.68 Favored Pre-proline 0 N--CA 1.492 1.632 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -55.37 110.19 0.52 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.211 1.941 . . . . 0.0 111.85 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -114.68 117.54 31.12 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -132.52 147.94 52.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.581 -0.699 . . . . 0.0 109.534 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -93.3 128.33 39.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.539 -0.726 . . . . 0.0 109.474 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.3 mt -110.01 127.5 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -132.0 133.27 44.26 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.582 -0.699 . . . . 0.0 109.395 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.42 125.6 40.15 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.661 0.744 . . . . 0.0 109.562 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.7 t -60.19 136.9 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.533 0.682 . . . . 0.0 110.694 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.47 -13.25 61.41 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.46 HG12 HH12 ' A' ' 38' ' ' ARG . 3.8 m -152.48 77.53 6.57 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.159 -1.201 . . . . 0.0 109.77 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -76.25 -9.49 19.04 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 122.476 2.117 . . . . 0.0 111.07 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.592 ' C ' ' H ' ' A' ' 39' ' ' THR . 71.0 m-20 -86.7 -145.49 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.63 -0.669 . . . . 0.0 109.957 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.46 HH12 HG12 ' A' ' 35' ' ' VAL . 84.9 mtt85 57.8 -0.84 0.09 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.442 0.639 . . . . 0.0 110.079 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.592 ' H ' ' C ' ' A' ' 37' ' ' ASP . 2.7 m 74.18 132.3 0.04 OUTLIER Pre-proline 0 C--N 1.296 -1.73 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.168 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.34 153.95 70.11 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.006 1.804 . . . . 0.0 112.272 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.6 mm -122.34 88.87 49.07 Favored Pre-proline 0 N--CA 1.494 1.732 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -55.25 146.6 59.81 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.662 2.241 . . . . 0.0 112.539 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.78 135.79 40.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.569 -0.707 . . . . 0.0 109.587 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.483 ' OG1' ' NH1' ' A' ' 18' ' ' ARG . 32.0 p -136.21 167.93 20.36 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -136.2 136.62 22.94 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.99 86.82 1.06 Allowed 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 121.974 1.783 . . . . 0.0 112.119 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.472 ' O ' ' CG1' ' A' ' 25' ' ' VAL . 8.9 tt0 -168.54 -173.35 1.9 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 109.213 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -133.69 121.17 21.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.609 -0.682 . . . . 0.0 109.26 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.508 ' C ' ' H ' ' A' ' 51' ' ' LEU . 91.8 m-85 -111.79 -36.88 5.31 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.9 t0 58.87 -0.3 0.14 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.775 -0.578 . . . . 0.0 109.925 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.8 mt -118.03 126.67 52.75 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.397 -0.815 . . . . 0.0 109.638 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.95 -42.49 80.85 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.591 -0.693 . . . . 0.0 109.641 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.66 -47.93 83.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.621 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 58' ' ' VAL . 38.7 t0 -67.0 -38.76 86.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.75 -40.98 98.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.304 -0.873 . . . . 0.0 109.216 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.87 -44.99 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.874 . . . . 0.0 109.649 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -65.63 -44.57 86.05 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.282 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 54' ' ' ASP . 72.0 t -67.87 -41.4 84.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.572 -0.705 . . . . 0.0 109.418 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.4 p -56.63 -41.32 76.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.207 -0.933 . . . . 0.0 109.616 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.34 -45.0 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.055 -1.028 . . . . 0.0 109.509 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.69 -46.04 73.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.375 -0.828 . . . . 0.0 109.96 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.5 m -66.24 -49.58 66.72 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.423 -0.798 . . . . 0.0 109.495 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -45.4 -46.14 13.1 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.679 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.59 -41.87 98.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.02 -43.93 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.152 -0.968 . . . . 0.0 109.466 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.64 -44.81 96.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -0.928 . . . . 0.0 108.621 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.07 -43.94 97.62 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 O-C-N 121.06 -1.025 . . . . 0.0 108.795 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.93 -41.82 97.53 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.317 -0.864 . . . . 0.0 109.19 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -60.91 -40.91 94.89 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.525 -0.734 . . . . 0.0 109.35 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -58.92 -44.84 91.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.194 -0.941 . . . . 0.0 109.157 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.14 -41.12 97.31 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.494 -0.754 . . . . 0.0 109.045 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -69.58 -68.33 0.42 Allowed 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.405 -0.809 . . . . 0.0 109.432 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -155.42 -80.9 0.08 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 109.273 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 61.78 158.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.67 0.748 . . . . 0.0 110.635 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -77.83 -85.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.584 -0.698 . . . . 0.0 109.723 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -139.71 77.41 1.61 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.572 -0.705 . . . . 0.0 109.16 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -98.16 -95.21 1.98 Allowed Glycine 0 N--CA 1.495 2.61 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -85.26 33.05 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -1.151 . . . . 0.0 108.414 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.624 -0.672 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.9 -45.57 91.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.366 -0.834 . . . . 0.0 109.618 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.54 -41.39 93.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.337 -0.852 . . . . 0.0 109.773 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.021 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 -179.486 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.0 mpp? . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.213 0.53 . . . . 0.0 109.786 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -81.29 162.16 23.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.0 110.51 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.9 m -85.02 156.5 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.429 -0.794 . . . . 0.0 109.978 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.61 138.84 51.12 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.72 -0.612 . . . . 0.0 109.594 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -99.6 114.81 28.07 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.393 -0.817 . . . . 0.0 109.531 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -86.72 -75.62 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.432 -0.792 . . . . 0.0 109.66 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -127.2 52.14 1.83 Allowed 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 93.96 -0.41 66.92 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -112.39 140.32 47.22 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.385 -1.068 . . . . 0.0 109.993 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -84.21 145.13 28.51 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -120.94 130.2 74.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -127.3 97.75 30.88 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.93 153.79 37.73 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.422 2.082 . . . . 0.0 113.201 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.71 -150.14 8.09 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.52 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 52.7 p-80 -152.67 147.53 26.22 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -1.111 . . . . 0.0 109.428 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.427 ' OE1' ' CZ ' ' A' ' 27' ' ' TYR . 58.4 tt0 -169.05 157.67 8.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.392 -0.818 . . . . 0.0 109.02 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -110.04 145.77 36.47 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.464 0.65 . . . . 0.0 110.002 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.559 HH21 ' CG2' ' A' ' 44' ' ' THR . 35.2 mmt180 -96.32 125.24 40.69 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.658 0.742 . . . . 0.0 109.728 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 38.5 p-10 -70.22 -21.5 63.01 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.715 -0.615 . . . . 0.0 109.959 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -62.33 -42.58 99.49 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.764 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.6 pt -116.7 -6.8 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' ARG . 28.0 mmt180 55.82 57.55 5.11 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.4 0.619 . . . . 0.0 110.034 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -144.09 160.17 41.36 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 0.0 109.788 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -90.23 129.28 36.5 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.628 -0.67 . . . . 0.0 109.375 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 11.8 m -141.93 148.97 51.15 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.447 -0.783 . . . . 0.0 109.544 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -41.48 110.1 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.294 0 C-N-CA 122.307 2.004 . . . . 0.0 111.536 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.427 ' CZ ' ' OE1' ' A' ' 16' ' ' GLN . 56.2 t80 -103.66 116.74 32.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.804 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -139.77 144.29 37.35 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.1 mt -109.96 130.45 55.53 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.8 mt -112.71 131.04 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -129.04 132.3 47.46 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -83.89 138.78 33.01 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.427 -0.796 . . . . 0.0 109.619 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.7 t -67.55 133.98 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.407 -0.808 . . . . 0.0 110.36 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.72 -15.83 56.72 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.436 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 23.8 m -153.53 54.69 1.19 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.287 -1.125 . . . . 0.0 109.637 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 29.7 Cg_endo -66.83 -17.64 52.15 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.581 2.187 . . . . 0.0 111.568 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.89 -135.28 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.463 -0.773 . . . . 0.0 110.359 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 52.64 176.33 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.775 0.797 . . . . 0.0 111.049 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 35.3 m -73.18 131.74 83.0 Favored Pre-proline 0 C--N 1.306 -1.294 0 O-C-N 121.486 -0.759 . . . . 0.0 110.003 -178.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.28 140.75 45.28 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.141 1.894 . . . . 0.0 112.582 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.93 103.27 54.85 Favored Pre-proline 0 N--CA 1.494 1.735 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.18 145.1 38.51 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.095 1.863 . . . . 0.0 112.061 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.804 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -108.64 137.49 46.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.548 -0.72 . . . . 0.0 109.457 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.559 ' CG2' HH21 ' A' ' 18' ' ' ARG . 45.8 p -138.09 167.85 20.95 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -130.99 140.39 38.53 Favored Pre-proline 0 N--CA 1.491 1.589 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -43.33 -28.25 1.49 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 122.207 1.938 . . . . 0.0 112.089 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.51 158.79 26.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.317 -0.864 . . . . 0.0 110.158 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -126.8 147.75 49.99 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.637 -0.665 . . . . 0.0 109.389 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.516 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 78.9 m-85 -152.44 114.52 4.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.326 -0.859 . . . . 0.0 109.801 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -71.13 -33.49 70.15 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.529 -0.732 . . . . 0.0 109.207 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -69.74 135.34 49.65 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.528 -0.733 . . . . 0.0 110.332 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.52 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 85.1 tt0 -71.74 -41.05 68.96 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.503 -0.748 . . . . 0.0 109.731 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.21 -45.94 86.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -0.874 . . . . 0.0 109.738 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.516 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.0 t0 -63.99 -38.58 91.6 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.346 -0.846 . . . . 0.0 109.546 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.64 91.83 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.47 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.81 -46.39 82.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.345 -0.847 . . . . 0.0 109.724 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -64.21 -44.38 92.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.325 -0.859 . . . . 0.0 109.621 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.3 t -67.32 -42.03 87.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.393 -0.817 . . . . 0.0 109.761 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.558 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 78.5 p -56.49 -40.75 75.47 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.688 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.441 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 96.6 mt -64.13 -45.66 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.983 -1.073 . . . . 0.0 109.155 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.09 -38.8 86.34 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.6 t -64.95 -50.55 65.98 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.537 -0.727 . . . . 0.0 109.437 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.66 -41.71 43.44 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.62 -0.675 . . . . 0.0 109.634 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.441 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 63.2 mttp -62.9 -41.35 99.41 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.293 -0.879 . . . . 0.0 109.337 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.5 mt -64.1 -43.84 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.839 . . . . 0.0 109.805 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 66' ' ' ILE . 2.0 mp -65.54 -45.33 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.0 109.129 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.62 -44.84 96.71 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.163 -0.961 . . . . 0.0 109.371 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -67.59 -43.78 79.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.333 -0.854 . . . . 0.0 109.719 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.402 ' HG ' ' HA ' ' A' ' 66' ' ' ILE . 78.0 p -67.04 -35.59 80.21 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.385 -0.822 . . . . 0.0 109.067 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.38 -43.99 92.81 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.285 -0.884 . . . . 0.0 109.394 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.9 mt -63.75 -40.99 98.06 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.377 -0.827 . . . . 0.0 109.218 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.438 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 57.3 t0 -68.96 -2.18 9.2 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.351 -0.843 . . . . 0.0 109.198 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 67.74 68.0 0.36 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.807 -0.558 . . . . 0.0 110.257 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -122.92 113.72 19.48 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.525 0.679 . . . . 0.0 109.236 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' GLN . 96.8 m-20 51.81 178.09 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.667 0.746 . . . . 0.0 110.965 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.425 ' O ' ' O ' ' A' ' 75' ' ' ASP . 85.9 mt-30 -48.16 -100.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.441 0.639 . . . . 0.0 110.348 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 79' ' ' ALA . . . 61.87 125.12 0.01 OUTLIER Glycine 0 N--CA 1.489 2.223 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.409 ' C ' ' O ' ' A' ' 77' ' ' GLY . 9.1 mt 41.68 22.99 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.52 -0.988 . . . . 0.0 109.586 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' A' ' 77' ' ' GLY . . . -60.21 -47.71 84.81 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.55 -0.719 . . . . 0.0 109.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -65.68 -36.54 83.93 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.339 -0.85 . . . . 0.0 109.451 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.9 mt -84.09 -3.19 57.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.388 -0.82 . . . . 0.0 109.255 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 179.984 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mtp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.294 0.569 . . . . 0.0 109.878 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -77.29 154.44 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.459 -0.775 . . . . 0.0 110.179 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.5 138.72 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.502 -0.749 . . . . 0.0 110.014 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -89.36 159.99 17.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.453 -0.779 . . . . 0.0 109.815 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.91 139.88 47.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.553 -0.717 . . . . 0.0 109.392 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -151.05 119.98 6.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.189 -0.945 . . . . 0.0 109.496 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 54.28 28.04 8.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.648 -0.658 . . . . 0.0 110.199 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 0.21 86.34 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -104.35 139.99 38.53 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.578 -0.954 . . . . 0.0 109.504 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.2 140.74 29.16 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.406 -0.809 . . . . 0.0 109.144 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -119.83 130.13 74.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -117.11 121.04 32.96 Favored Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.02 157.68 46.6 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.059 1.839 . . . . 0.0 112.565 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.05 -172.27 44.3 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.7 p80 -150.7 146.06 26.21 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.339 -1.095 . . . . 0.0 109.073 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.51 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 53.8 tt0 -168.47 155.62 7.66 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.276 -0.89 . . . . 0.0 109.002 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -104.91 139.9 38.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.494 -0.754 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.2 mtp180 -90.97 134.43 34.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.559 -0.713 . . . . 0.0 109.566 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 39.0 p-10 -68.29 -21.49 64.78 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.368 -0.833 . . . . 0.0 109.247 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -60.9 -47.68 85.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.554 -0.716 . . . . 0.0 109.867 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 18.6 pt -107.39 -2.5 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.473 -0.767 . . . . 0.0 108.99 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 49.21 46.64 22.77 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.504 -0.747 . . . . 0.0 110.051 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.25 165.9 26.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -0.821 . . . . 0.0 109.598 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -85.04 132.78 34.28 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.541 -0.725 . . . . 0.0 109.766 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.77 156.03 41.26 Favored Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.285 -0.884 . . . . 0.0 108.794 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -43.85 128.94 7.26 Favored 'Trans proline' 0 C--N 1.314 -1.273 0 C-N-CA 122.11 1.873 . . . . 0.0 112.067 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.51 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 66.0 t80 -131.85 120.38 22.5 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 59' ' ' SER . . . -144.53 151.71 39.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.168 -0.958 . . . . 0.0 108.789 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.2 mt -106.11 129.93 54.1 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.6 mt -110.68 130.44 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.638 -0.664 . . . . 0.0 109.32 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -131.24 126.66 36.06 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -81.49 139.24 35.28 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.339 -0.851 . . . . 0.0 109.741 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 69.9 t -65.62 134.83 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 110.246 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.61 -22.04 37.0 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.7 m -152.46 65.06 5.8 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.154 -1.203 . . . . 0.0 110.158 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.41 -37.01 97.89 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 122.239 1.96 . . . . 0.0 110.918 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -65.01 -125.54 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.074 0.464 . . . . 0.0 110.474 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' THR . 83.6 mmt-85 52.83 28.62 6.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.488 -0.758 . . . . 0.0 109.339 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.426 ' O ' ' O ' ' A' ' 38' ' ' ARG . 27.5 m 60.72 130.59 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.382 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -73.01 152.58 51.63 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 122.339 2.026 . . . . 0.0 112.512 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.6 mm -129.0 89.3 49.1 Favored Pre-proline 0 N--CA 1.499 1.987 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -56.1 145.75 73.87 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.317 2.011 . . . . 0.0 111.547 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -117.1 135.4 53.77 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.556 0.693 . . . . 0.0 109.821 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.0 p -138.03 166.2 24.68 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -133.01 133.89 23.74 Favored Pre-proline 0 N--CA 1.495 1.798 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.82 85.14 1.36 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.957 1.772 . . . . 0.0 112.329 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.443 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 80.7 tt0 -138.62 -16.18 1.17 Allowed 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 47' ' ' GLU . 9.6 m-85 58.39 119.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.131 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.533 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 12.4 m-85 -131.37 133.97 45.82 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.736 0.779 . . . . 0.0 109.419 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -85.06 -24.76 27.99 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.706 -0.621 . . . . 0.0 109.456 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.4 mm? -96.91 126.17 41.87 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 122.079 0.943 . . . . 0.0 109.854 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -67.76 -33.36 74.68 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.53 -47.32 86.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.609 -0.682 . . . . 0.0 110.016 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 14.9 t70 -64.35 -34.39 78.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.513 -0.742 . . . . 0.0 109.342 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.2 -42.3 90.58 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.564 -0.71 . . . . 0.0 109.538 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -64.13 -49.3 72.72 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.449 -0.782 . . . . 0.0 109.845 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -63.59 -43.93 95.5 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.488 -0.758 . . . . 0.0 109.418 -179.516 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.3 t -64.17 -42.27 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.374 -0.829 . . . . 0.0 109.286 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.539 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 31.2 m -52.39 -42.95 64.44 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.272 -0.892 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.02 -44.77 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.279 -0.888 . . . . 0.0 109.265 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.89 71.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.438 -0.789 . . . . 0.0 109.698 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.93 -43.29 99.16 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.484 -0.76 . . . . 0.0 109.147 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.34 -42.44 41.74 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.403 -0.811 . . . . 0.0 109.285 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -62.58 -43.67 98.23 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.38 -0.825 . . . . 0.0 109.251 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -65.82 -45.19 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.502 -0.749 . . . . 0.0 109.791 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.3 -44.47 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 0.0 109.165 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.03 -45.02 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.134 -0.979 . . . . 0.0 109.112 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -65.13 -44.26 89.23 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.468 -0.77 . . . . 0.0 109.606 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.558 ' O ' ' N ' ' A' ' 73' ' ' ARG . 39.4 m -63.76 -36.64 84.55 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.583 -0.698 . . . . 0.0 109.641 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 13.6 t60 -57.8 -50.62 72.66 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.1 mt -66.5 -42.01 88.03 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.48 -0.762 . . . . 0.0 110.171 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' O ' ' O ' ' A' ' 73' ' ' ARG . 91.7 m-20 -90.6 -67.3 0.86 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.36 -0.838 . . . . 0.0 110.279 -179.274 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.558 ' N ' ' O ' ' A' ' 69' ' ' SER . 33.9 ttm-85 -58.76 -141.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.653 0.739 . . . . 0.0 110.781 -178.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -67.14 144.17 56.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.597 -0.689 . . . . 0.0 110.311 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.405 ' N ' ' OD1' ' A' ' 75' ' ' ASP . 35.1 p-10 -92.68 4.71 53.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.491 -0.755 . . . . 0.0 109.131 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.89 -39.99 94.39 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.421 -0.799 . . . . 0.0 109.611 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.451 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . -69.0 142.93 38.78 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.4 mt 55.1 20.44 3.31 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.491 -1.005 . . . . 0.0 109.388 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.92 89.17 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.416 -0.802 . . . . 0.0 109.677 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.01 -37.45 87.25 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.362 -0.836 . . . . 0.0 109.475 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 44.1 mt -82.48 -3.8 56.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.383 -0.823 . . . . 0.0 109.428 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.514 0.674 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -90.05 -72.19 0.58 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.482 -0.761 . . . . 0.0 109.7 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.481 ' CG1' ' OE1' ' A' ' 12' ' ' GLU . 15.3 m -78.16 149.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 0.0 110.435 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.73 153.02 19.18 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.501 -0.749 . . . . 0.0 109.622 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -103.65 128.65 50.93 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.574 -0.704 . . . . 0.0 109.771 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -143.03 121.89 12.7 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.403 -0.811 . . . . 0.0 109.574 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 54.14 24.73 5.06 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.534 0.683 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.62 4.09 80.16 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -109.53 139.5 44.46 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.532 -0.981 . . . . 0.0 109.975 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -87.28 144.93 26.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.391 -0.818 . . . . 0.0 109.577 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -123.47 131.79 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.667 -0.645 . . . . 0.0 109.417 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.481 ' OE1' ' CG1' ' A' ' 3' ' ' VAL . 8.8 tp10 -116.0 117.63 39.19 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.19 155.0 32.96 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.187 1.925 . . . . 0.0 112.845 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.99 -163.76 36.2 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -151.27 146.46 26.06 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.026 -1.279 . . . . 0.0 109.346 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.48 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 49.2 tt0 -166.23 155.31 11.34 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.165 -0.959 . . . . 0.0 109.755 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -107.24 135.51 48.64 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.316 0.579 . . . . 0.0 109.849 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.491 ' O ' ' N ' ' A' ' 22' ' ' ARG . 79.9 mtp85 -96.08 137.97 34.38 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.83 0.824 . . . . 0.0 109.981 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -67.31 -21.98 65.65 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.524 0.678 . . . . 0.0 109.306 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.61 -44.52 96.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.449 -0.782 . . . . 0.0 109.906 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.1 pt -114.68 0.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.491 ' N ' ' O ' ' A' ' 18' ' ' ARG . 84.5 mtt85 43.56 41.08 3.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.546 -0.721 . . . . 0.0 110.235 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -136.69 159.83 40.65 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.414 -0.804 . . . . 0.0 109.793 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -87.18 119.23 27.2 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.453 0.644 . . . . 0.0 109.735 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.6 m -130.93 152.83 81.32 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -41.74 114.11 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.722 1.615 . . . . 0.0 111.282 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.48 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 64.7 t80 -111.47 121.32 44.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.595 -0.691 . . . . 0.0 109.644 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 59' ' ' SER . . . -143.56 154.98 44.15 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.326 -0.859 . . . . 0.0 108.985 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.0 mt -112.31 132.46 54.95 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -113.09 131.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.419 ' NH2' ' OD1' ' A' ' 37' ' ' ASP . 58.4 ttm-85 -132.67 136.69 46.61 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.605 -0.685 . . . . 0.0 109.689 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -80.19 134.29 36.12 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.689 0.757 . . . . 0.0 109.735 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t -83.27 130.37 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.479 -0.763 . . . . 0.0 110.501 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 126.75 -48.71 0.95 Allowed Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.445 ' O ' ' O ' ' A' ' 36' ' ' PRO . 33.6 m -92.34 151.49 41.51 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.189 -1.183 . . . . 0.0 110.135 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' VAL . 53.0 Cg_exo -48.96 -168.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.349 2.033 . . . . 0.0 113.076 179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.419 ' OD1' ' NH2' ' A' ' 31' ' ' ARG . 67.5 t0 -82.44 93.43 7.23 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.487 -0.758 . . . . 0.0 109.277 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.456 ' CZ ' ' O ' ' A' ' 80' ' ' ASP . 84.8 mtp180 -90.68 161.51 15.33 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.473 -0.767 . . . . 0.0 110.057 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.2 m -45.69 108.76 0.84 Allowed Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.471 -0.768 . . . . 0.0 109.821 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.95 154.13 37.89 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.169 1.913 . . . . 0.0 112.682 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.497 HD12 ' N ' ' A' ' 41' ' ' ILE . 4.3 mp -121.99 130.12 24.86 Favored Pre-proline 0 N--CA 1.494 1.738 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.4 148.93 55.68 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.125 1.883 . . . . 0.0 112.488 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.542 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -119.98 129.99 54.55 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.68 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.3 p -140.05 167.41 22.2 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 47' ' ' GLU . 9.2 t80 -135.58 136.53 24.02 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.637 -0.664 . . . . 0.0 109.626 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -45.38 81.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.373 2.049 . . . . 0.0 112.183 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 45' ' ' TYR . 6.3 pt-20 178.08 133.8 0.07 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -116.61 163.17 16.5 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.725 0.774 . . . . 0.0 109.491 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.512 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 90.0 m-85 -145.15 -35.24 0.32 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.583 -0.698 . . . . 0.0 109.257 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 49' ' ' TYR . 5.4 t0 79.84 -18.12 0.53 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 51' ' ' LEU . 3.6 mm? -98.98 126.36 44.66 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 122.185 0.993 . . . . 0.0 110.153 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -32.25 73.7 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.548 ' HB1' HH12 ' A' ' 57' ' ' ARG . . . -61.88 -51.79 66.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.307 -0.871 . . . . 0.0 109.914 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.512 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 39.2 t0 -72.14 -36.76 69.45 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.711 0.767 . . . . 0.0 109.486 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.08 -47.37 85.49 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.424 -0.798 . . . . 0.0 109.922 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.42 -45.1 89.01 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.548 HH12 ' HB1' ' A' ' 53' ' ' ALA . 84.8 mtt85 -63.87 -45.09 91.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.127 -0.983 . . . . 0.0 109.924 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -67.56 -42.34 86.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.333 -0.854 . . . . 0.0 109.093 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.575 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 99.9 p -55.76 -40.61 72.84 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.446 -0.784 . . . . 0.0 109.668 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.1 mt -64.94 -45.01 96.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.95 -1.094 . . . . 0.0 109.646 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.44 -42.26 79.11 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.048 -1.033 . . . . 0.0 109.549 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 90.6 m -68.55 -39.16 81.19 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.459 -0.776 . . . . 0.0 109.476 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -46.79 71.34 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.238 -0.914 . . . . 0.0 109.064 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -63.17 -41.73 99.28 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.39 -42.79 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.823 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.2 mm -63.69 -43.24 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.04 -1.037 . . . . 0.0 109.191 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 91.8 mt -62.88 -47.71 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 120.993 -1.067 . . . . 0.0 109.377 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -66.14 -44.12 85.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.381 -0.824 . . . . 0.0 109.698 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.55 ' O ' ' N ' ' A' ' 73' ' ' ARG . 11.8 t -63.23 -41.43 99.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.487 -0.758 . . . . 0.0 109.315 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.519 ' O ' ' N ' ' A' ' 74' ' ' HIS . 73.5 t60 -58.77 -39.08 79.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.423 -0.798 . . . . 0.0 109.634 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.481 ' O ' ' NE2' ' A' ' 74' ' ' HIS . 85.5 mt -63.4 -42.54 98.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.223 -0.923 . . . . 0.0 110.112 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -94.24 -13.8 26.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.234 -0.917 . . . . 0.0 110.192 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.55 ' N ' ' O ' ' A' ' 69' ' ' SER . 65.2 ttt180 -106.98 -41.75 5.1 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.311 -0.868 . . . . 0.0 109.6 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.519 ' N ' ' O ' ' A' ' 70' ' ' HIS . 89.3 m-70 56.5 75.7 0.34 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.964 0.888 . . . . 0.0 109.324 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.52 ' O ' ' CB ' ' A' ' 76' ' ' GLN . 42.0 p-10 -93.6 16.04 14.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.676 -0.64 . . . . 0.0 109.398 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 75' ' ' ASP . 2.5 tm0? 82.76 -24.2 0.18 Allowed 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.535 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . -64.36 154.0 48.26 Favored Glycine 0 N--CA 1.493 2.444 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.089 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.8 mt 63.04 -9.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 122.004 -0.704 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.535 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.9 -34.17 77.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.003 -1.06 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.466 ' HB2' HD11 ' A' ' 41' ' ' ILE . 99.2 m-20 -65.01 -13.95 59.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.428 -0.795 . . . . 0.0 109.474 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.99 -5.17 59.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.22 -0.925 . . . . 0.0 109.003 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.79 -1.561 . . . . 0.0 109.321 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mtm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -86.44 -4.13 59.12 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.567 -0.708 . . . . 0.0 109.134 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.54 149.8 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.356 -0.84 . . . . 0.0 110.006 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.22 135.44 54.68 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.637 -0.664 . . . . 0.0 109.28 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -84.6 146.7 27.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.429 -0.794 . . . . 0.0 110.373 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -154.6 119.16 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.527 -0.733 . . . . 0.0 109.117 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? 54.69 26.81 7.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.627 -0.67 . . . . 0.0 109.921 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.63 2.8 81.59 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -107.45 140.08 40.96 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.553 -0.969 . . . . 0.0 109.709 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -89.92 142.08 28.04 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.5 -0.75 . . . . 0.0 109.476 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -123.97 132.75 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -119.91 87.95 39.35 Favored Pre-proline 0 N--CA 1.496 1.835 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.66 149.4 68.12 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 122.734 2.289 . . . . 0.0 112.463 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.24 139.68 4.69 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 15' ' ' HIS . 45.2 p-80 -95.1 123.23 38.48 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.521 -0.988 . . . . 0.0 109.96 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -149.91 153.16 36.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.156 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -104.36 138.9 40.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.636 -0.665 . . . . 0.0 109.468 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -103.02 141.9 35.02 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.489 0.661 . . . . 0.0 110.349 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -68.77 -8.81 46.57 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.292 -0.88 . . . . 0.0 109.378 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -68.06 -52.86 30.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.49 ' CD1' ' H ' ' A' ' 23' ' ' LYS . 1.2 pp -108.26 7.27 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 40.89 37.92 0.59 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.823 -0.548 . . . . 0.0 110.123 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' H ' ' CD1' ' A' ' 21' ' ' ILE . 34.7 mmtt -141.16 176.79 8.55 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.352 -0.843 . . . . 0.0 109.706 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -86.82 127.43 35.01 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.303 0.573 . . . . 0.0 109.633 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -138.61 154.75 73.52 Favored Pre-proline 0 N--CA 1.493 1.681 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -58.52 110.29 0.63 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.239 1.959 . . . . 0.0 111.496 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -112.62 118.4 34.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.514 -0.741 . . . . 0.0 109.37 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 43' ' ' THR . . . -144.01 153.6 42.39 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -102.82 133.88 47.16 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.634 -0.666 . . . . 0.0 109.554 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.3 mt -110.0 128.07 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -136.41 138.86 41.98 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.628 -0.67 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -93.61 134.69 35.65 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.474 -0.766 . . . . 0.0 109.556 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.439 ' C ' ' H ' ' A' ' 35' ' ' VAL . 91.2 t -63.23 -43.79 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.589 -0.694 . . . . 0.0 110.224 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.55 3.3 1.96 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.439 ' H ' ' C ' ' A' ' 33' ' ' VAL . 4.8 t -146.54 71.2 12.82 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.066 -1.255 . . . . 0.0 109.195 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.437 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 31.7 Cg_exo -56.24 -43.86 52.04 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.18 1.92 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -95.82 112.16 23.96 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.423 0.63 . . . . 0.0 109.719 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.515 ' HE ' ' C ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -168.63 -165.24 0.56 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.1 m -112.0 97.6 38.95 Favored Pre-proline 0 N--CA 1.496 1.828 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.54 143.49 55.87 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 122.35 2.034 . . . . 0.0 112.127 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.3 mp -124.03 125.04 25.89 Favored Pre-proline 0 N--CA 1.491 1.601 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -71.63 143.96 43.37 Favored 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 121.842 1.694 . . . . 0.0 112.278 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 28' ' ' ALA . 1.3 t -107.2 137.0 46.09 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -130.52 165.07 23.48 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.536 ' O ' ' N ' ' A' ' 47' ' ' GLU . 24.2 t80 -139.1 110.74 7.81 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -45.53 83.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.966 1.777 . . . . 0.0 112.33 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 45' ' ' TYR . 8.4 tm-20 -171.91 132.24 0.69 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.252 -0.905 . . . . 0.0 109.085 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -98.9 125.66 44.37 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 108.991 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.526 ' CE2' ' OE1' ' A' ' 47' ' ' GLU . 84.8 m-85 -109.03 -32.37 7.27 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.6 t0 62.97 -3.8 0.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.4 mt -115.47 131.54 56.9 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.595 -0.691 . . . . 0.0 109.737 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -68.47 -39.43 81.39 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.651 -0.656 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -50.34 74.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.74 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -64.34 -40.2 95.41 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.46 -0.775 . . . . 0.0 109.427 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.77 92.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.476 -0.765 . . . . 0.0 109.95 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -66.98 -49.37 65.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.403 -0.81 . . . . 0.0 110.1 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -64.98 -44.2 90.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.334 -0.854 . . . . 0.0 109.659 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.7 t -66.7 -42.37 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.56 -0.712 . . . . 0.0 109.564 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 p -54.72 -40.41 69.22 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.245 -0.909 . . . . 0.0 109.549 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -65.22 -45.02 95.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.204 -0.935 . . . . 0.0 109.368 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.34 51.83 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.404 -0.81 . . . . 0.0 109.733 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.1 m -60.92 -38.9 87.36 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.557 -0.715 . . . . 0.0 109.28 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.86 -41.12 70.42 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.46 -0.775 . . . . 0.0 109.188 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.18 -38.71 92.24 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.338 -0.852 . . . . 0.0 109.123 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.56 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.453 -0.779 . . . . 0.0 109.665 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.35 -44.35 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.339 -0.851 . . . . 0.0 108.746 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.68 -44.36 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.313 -0.867 . . . . 0.0 109.272 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.49 -41.51 96.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.563 -0.711 . . . . 0.0 109.573 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.514 ' O ' ' N ' ' A' ' 73' ' ' ARG . 50.8 m -61.58 -41.99 98.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.529 -0.732 . . . . 0.0 110.012 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -61.21 -47.16 87.4 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.125 -0.984 . . . . 0.0 109.467 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.87 -42.2 95.03 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.481 -0.762 . . . . 0.0 109.321 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -82.39 -70.08 0.57 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.553 -0.717 . . . . 0.0 109.653 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' SER . 85.8 mtp180 -73.88 147.63 43.05 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.533 -0.73 . . . . 0.0 110.098 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -78.4 62.24 2.99 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 0.0 109.048 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 77' ' ' GLY . 62.2 t0 -87.65 110.82 20.68 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.482 -0.761 . . . . 0.0 109.699 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -68.92 11.57 0.19 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.525 -0.734 . . . . 0.0 109.533 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.504 ' H ' ' C ' ' A' ' 75' ' ' ASP . . . -60.73 -40.97 98.82 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.689 -1.365 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.3 mt -112.16 32.68 5.35 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.959 . . . . 0.0 109.138 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.71 88.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.553 -0.717 . . . . 0.0 109.554 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.69 -34.77 79.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.595 -0.691 . . . . 0.0 109.899 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.2 mt -80.18 -2.93 46.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.617 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 CA-C-O 117.866 -1.519 . . . . 0.0 109.428 179.747 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.41 ' O ' ' O ' ' A' ' 2' ' ' ASN . 37.7 ttm . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.41 ' O ' ' O ' ' A' ' 1' ' ' MET . 99.5 m-20 42.96 -168.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.712 0.768 . . . . 0.0 111.043 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.4 m -75.04 141.35 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.688 0.756 . . . . 0.0 110.264 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.04 131.3 43.98 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.76 0.79 . . . . 0.0 109.706 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -83.86 149.26 26.49 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.671 0.748 . . . . 0.0 110.184 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -153.43 113.65 3.96 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.763 0.792 . . . . 0.0 109.401 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.8 mtp180 49.41 29.52 2.88 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.631 0.729 . . . . 0.0 110.104 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 96.23 -19.61 53.77 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -83.71 142.14 30.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -1.029 . . . . 0.0 110.625 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.49 145.81 24.53 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.624 -0.673 . . . . 0.0 109.604 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 94.6 mt -125.21 129.72 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-O 121.483 0.659 . . . . 0.0 109.483 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -123.68 93.23 47.73 Favored Pre-proline 0 N--CA 1.495 1.781 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.49 157.46 32.58 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.759 2.306 . . . . 0.0 113.209 -178.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.3 -133.71 1.75 Allowed Glycine 0 N--CA 1.488 2.153 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.545 ' ND1' ' OE2' ' A' ' 52' ' ' GLU . 20.2 p-80 -160.05 135.67 8.33 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.435 -1.038 . . . . 0.0 109.899 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.668 ' NE2' ' CE1' ' A' ' 27' ' ' TYR . 13.7 tt0 -166.62 154.4 9.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.639 -0.663 . . . . 0.0 109.301 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.9 p90 -112.79 144.62 42.01 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 121.711 0.767 . . . . 0.0 109.942 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.693 ' HE ' HG21 ' A' ' 44' ' ' THR . 94.6 mtt-85 -99.15 137.67 37.35 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.622 0.725 . . . . 0.0 109.969 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -68.21 -20.31 64.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.774 -0.579 . . . . 0.0 109.886 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -65.37 -42.43 92.75 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.314 -0.866 . . . . 0.0 109.917 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 11.4 pt -109.91 -6.16 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.47 -0.769 . . . . 0.0 109.016 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 48.25 44.13 19.45 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.807 0.813 . . . . 0.0 109.964 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -145.56 163.21 35.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.509 -0.745 . . . . 0.0 110.202 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -86.22 132.12 34.08 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.843 0.83 . . . . 0.0 110.229 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.8 m -142.49 148.72 48.22 Favored Pre-proline 0 N--CA 1.491 1.592 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -39.94 109.99 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.395 2.063 . . . . 0.0 111.416 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.668 ' CE1' ' NE2' ' A' ' 16' ' ' GLN . 56.1 t80 -104.08 120.29 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.603 0.716 . . . . 0.0 109.961 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.617 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -142.13 145.8 34.65 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.496 -0.753 . . . . 0.0 109.097 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.41 HD21 ' CE2' ' A' ' 27' ' ' TYR . 65.7 mt -110.14 126.57 54.2 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 91.0 mt -104.05 127.45 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.516 0.674 . . . . 0.0 109.532 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -130.1 137.98 50.45 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.59 0.71 . . . . 0.0 109.464 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -95.2 130.53 41.9 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 109.28 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.74 131.41 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.3 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 122.98 -38.76 2.42 Favored Glycine 0 N--CA 1.497 2.736 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.6 m -152.86 58.51 2.46 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.321 -1.105 . . . . 0.0 110.003 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -74.5 -170.88 0.8 Allowed 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.356 2.037 . . . . 0.0 111.965 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 56.34 36.45 27.53 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.606 0.717 . . . . 0.0 109.298 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.413 ' O ' ' C ' ' A' ' 39' ' ' THR . 23.5 mmt180 -117.62 90.02 3.24 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.507 0.67 . . . . 0.0 109.684 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.413 ' C ' ' O ' ' A' ' 38' ' ' ARG . 7.8 m 42.31 81.11 0.26 Allowed Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.71 144.14 98.2 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.348 2.032 . . . . 0.0 112.393 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.14 89.97 51.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -52.87 141.6 55.04 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 C-N-CA 122.517 2.145 . . . . 0.0 112.227 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.617 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 12.1 t -108.65 134.61 51.15 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.812 0.815 . . . . 0.0 110.003 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.693 HG21 ' HE ' ' A' ' 18' ' ' ARG . 56.9 p -139.66 166.85 23.5 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.608 ' O ' ' N ' ' A' ' 47' ' ' GLU . 8.8 t80 -136.05 133.42 19.7 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -42.78 76.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.898 2.399 . . . . 0.0 112.382 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.608 ' N ' ' O ' ' A' ' 45' ' ' TYR . 39.8 mt-10 -155.06 145.05 21.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.564 -0.71 . . . . 0.0 109.131 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -115.39 110.15 18.93 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.696 -0.628 . . . . 0.0 109.345 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.419 ' CE2' HG21 ' A' ' 58' ' ' VAL . 48.6 m-85 -124.28 129.79 51.37 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.557 0.694 . . . . 0.0 109.669 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -92.99 -24.84 18.23 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -78.68 143.02 36.67 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.826 0.822 . . . . 0.0 110.323 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.545 ' OE2' ' ND1' ' A' ' 15' ' ' HIS . 46.2 tp10 -71.89 -38.49 69.97 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.578 0.704 . . . . 0.0 109.758 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.97 87.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.79 . . . . 0.0 109.862 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 58' ' ' VAL . 34.9 m-20 -63.68 -43.43 96.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 109.739 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.12 88.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.512 -0.743 . . . . 0.0 109.899 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -69.37 -45.08 70.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.487 -0.758 . . . . 0.0 110.08 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -64.07 -45.4 88.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.335 -0.853 . . . . 0.0 110.037 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.419 HG21 ' CE2' ' A' ' 49' ' ' TYR . 75.7 t -67.53 -41.79 86.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.558 0.694 . . . . 0.0 109.742 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.52 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 88.1 p -57.18 -42.43 81.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.37 -0.831 . . . . 0.0 110.045 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.87 -45.07 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.117 -0.989 . . . . 0.0 109.645 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.89 -49.45 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.222 -0.924 . . . . 0.0 109.805 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.1 m -61.82 -35.19 77.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.473 -0.767 . . . . 0.0 109.485 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.55 -41.03 89.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.395 -0.815 . . . . 0.0 109.523 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.26 -45.74 86.78 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.296 -0.877 . . . . 0.0 109.805 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.404 ' N ' HD12 ' A' ' 65' ' ' ILE . 3.0 mp -67.47 -42.08 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.369 -0.832 . . . . 0.0 109.818 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -62.22 -43.74 98.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 121.384 -0.822 . . . . 0.0 109.789 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.95 -44.71 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.228 -0.92 . . . . 0.0 109.319 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.457 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 73.9 m-20 -64.24 -44.06 92.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.378 -0.826 . . . . 0.0 109.264 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.414 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 77.2 p -64.47 -47.6 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 0.0 109.768 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.465 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 17.8 t-80 -47.06 -44.02 20.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.293 -0.879 . . . . 0.0 109.441 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.402 HD13 HH22 ' A' ' 7' ' ' ARG . 90.0 mt -63.34 -40.72 98.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.38 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -135.57 72.57 1.45 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.453 -0.779 . . . . 0.0 109.266 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.414 ' CB ' ' O ' ' A' ' 69' ' ' SER . 11.0 tpp85 -174.06 -127.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.511 0.672 . . . . 0.0 109.973 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -51.47 130.91 28.56 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.92 0.867 . . . . 0.0 110.347 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 49.6 p-10 -65.05 136.07 56.32 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 121.741 0.782 . . . . 0.0 110.707 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 57.58 156.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.802 0.81 . . . . 0.0 110.784 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.12 -74.05 0.18 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.465 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 59.5 mt -102.59 14.65 31.42 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.326 -1.102 . . . . 0.0 109.201 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.12 -26.08 68.38 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.505 -0.747 . . . . 0.0 109.9 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -68.08 -17.16 64.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.325 -0.859 . . . . 0.0 109.676 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.9 mt -92.93 -2.13 56.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.186 -0.947 . . . . 0.0 109.262 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.807 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 tpp . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -86.4 114.88 23.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.444 -0.785 . . . . 0.0 109.975 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.8 m -81.14 151.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 CA-C-O 121.666 0.746 . . . . 0.0 110.441 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.8 139.89 48.05 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -101.63 122.48 43.95 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.737 0.779 . . . . 0.0 109.876 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -101.69 -101.12 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.403 0.621 . . . . 0.0 109.509 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -90.96 51.46 1.96 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.361 -0.837 . . . . 0.0 109.546 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.7 90.51 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.06 138.19 44.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.506 -0.997 . . . . 0.0 109.896 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -80.45 141.07 35.6 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.629 -0.669 . . . . 0.0 109.379 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.6 mt -119.47 129.0 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.38 0.61 . . . . 0.0 109.448 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -132.22 97.97 17.58 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -76.94 154.11 33.3 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.622 2.215 . . . . 0.0 112.868 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.2 102.89 0.17 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -42.05 129.68 3.6 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.69 -0.888 . . . . 0.0 110.713 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.441 ' CD ' ' H ' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -156.93 158.1 36.02 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.614 0.721 . . . . 0.0 109.427 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.441 ' H ' ' CD ' ' A' ' 16' ' ' GLN . 48.3 p90 -113.5 145.8 40.63 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.817 0.817 . . . . 0.0 110.038 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.636 HH21 ' CG2' ' A' ' 44' ' ' THR . 32.3 mmt180 -92.51 130.75 38.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.767 0.794 . . . . 0.0 109.612 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 45.1 p-10 -71.72 -23.78 61.68 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.73 -0.606 . . . . 0.0 109.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 90.7 m-20 -61.79 -44.64 96.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.6 pt -109.39 -7.63 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.378 -0.826 . . . . 0.0 109.102 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 54.8 53.43 10.51 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.591 0.71 . . . . 0.0 110.197 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -146.53 162.36 38.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.383 -0.823 . . . . 0.0 110.377 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -88.14 128.53 35.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.617 -0.677 . . . . 0.0 109.664 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.8 m -147.14 148.24 31.45 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.484 -0.76 . . . . 0.0 109.391 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -42.47 109.23 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 122.282 1.988 . . . . 0.0 111.508 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.407 ' OH ' HD21 ' A' ' 29' ' ' LEU . 75.0 t80 -112.39 120.96 43.47 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.347 -0.846 . . . . 0.0 110.163 -179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.807 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -137.72 145.67 42.79 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.427 HD13 ' NH2' ' A' ' 31' ' ' ARG . 83.1 mt -101.78 130.26 48.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.537 -0.727 . . . . 0.0 109.301 -179.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 93.1 mt -109.64 124.4 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 CA-C-O 121.579 0.704 . . . . 0.0 109.901 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.427 ' NH2' HD13 ' A' ' 29' ' ' LEU . 3.9 mpt_? -130.61 140.44 50.42 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.644 0.735 . . . . 0.0 109.572 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -86.9 137.25 32.54 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-O 121.606 0.717 . . . . 0.0 109.643 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.17 132.47 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 CA-C-O 121.806 0.812 . . . . 0.0 110.583 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.39 -20.65 43.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.441 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 27.9 m -152.66 53.22 1.0 Allowed Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.364 -1.08 . . . . 0.0 110.094 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 64.6 Cg_endo -74.1 -11.78 23.35 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.736 2.29 . . . . 0.0 110.815 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -75.02 -4.91 41.12 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.61 -0.681 . . . . 0.0 109.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.447 ' O ' ' C ' ' A' ' 39' ' ' THR . 37.7 mmt180 -81.2 144.14 31.83 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.385 -0.822 . . . . 0.0 110.241 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 38' ' ' ARG . 24.9 m -35.04 98.42 0.15 Allowed Pre-proline 0 N--CA 1.495 1.797 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.203 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.08 146.91 46.14 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.427 2.085 . . . . 0.0 112.721 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -109.75 111.02 59.19 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.55 157.42 44.67 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.546 2.164 . . . . 0.0 112.461 -179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.807 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 1.0 OUTLIER -121.97 135.55 54.86 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.577 0.703 . . . . 0.0 109.71 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.636 ' CG2' HH21 ' A' ' 18' ' ' ARG . 43.7 p -131.03 166.84 20.14 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' A' ' 47' ' ' GLU . 1.1 t80 -135.58 133.19 20.08 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.509 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 77.1 Cg_exo -45.23 -12.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.313 2.009 . . . . 0.0 111.468 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' TYR . 97.0 mt-10 -84.0 160.27 21.05 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.57 -0.706 . . . . 0.0 109.937 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -131.28 148.65 52.71 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.598 0.713 . . . . 0.0 109.362 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.527 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 62.4 m-85 -149.62 118.91 6.82 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.477 -0.765 . . . . 0.0 109.241 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -74.12 -13.39 60.82 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -94.67 128.54 41.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 109.877 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -67.79 -36.15 79.93 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.483 0.659 . . . . 0.0 110.19 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.36 -43.87 92.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.365 -0.834 . . . . 0.0 109.753 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 51.3 t0 -65.94 -38.85 89.7 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.417 -0.802 . . . . 0.0 109.544 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.95 -37.07 86.07 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.531 -0.731 . . . . 0.0 109.595 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -64.48 -50.24 68.23 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.392 -0.818 . . . . 0.0 109.807 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -67.27 -44.06 80.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.833 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 54' ' ' ASP . 74.4 t -67.4 -42.98 87.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.457 -0.777 . . . . 0.0 110.238 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.487 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 77.8 p -59.6 -41.08 89.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 110.206 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -65.83 -44.44 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 120.987 -1.07 . . . . 0.0 109.473 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -45.2 76.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.437 -0.789 . . . . 0.0 109.898 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.57 -46.38 72.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.361 -0.837 . . . . 0.0 109.985 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -48.2 -46.15 34.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.448 -0.783 . . . . 0.0 109.799 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.34 -41.82 98.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.361 -0.837 . . . . 0.0 109.418 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 91.0 mt -64.47 -44.03 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.505 -0.747 . . . . 0.0 109.691 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.15 -43.99 99.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.01 -44.03 99.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 O-C-N 121.583 -0.698 . . . . 0.0 109.2 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.23 -42.62 93.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.668 0.747 . . . . 0.0 109.301 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' ARG . 38.7 t -69.92 -34.12 73.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.554 -0.716 . . . . 0.0 109.789 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.698 ' CD2' HD12 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -57.75 -47.74 81.62 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.282 -0.886 . . . . 0.0 108.78 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.435 ' HG ' ' CD2' ' A' ' 70' ' ' HIS . 77.5 mt -64.25 -40.32 95.77 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -82.46 -78.86 0.19 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.508 0.67 . . . . 0.0 109.711 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 69' ' ' SER . 84.8 mtt85 -80.54 147.18 30.93 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.682 0.753 . . . . 0.0 110.669 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.411 ' O ' ' O ' ' A' ' 73' ' ' ARG . 62.5 m170 58.22 121.89 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.803 0.811 . . . . 0.0 110.417 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -93.4 -18.45 22.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 0.0 109.175 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.41 ' O ' ' C ' ' A' ' 77' ' ' GLY . 99.0 mm-40 -80.95 -6.33 58.58 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.317 -0.865 . . . . 0.0 109.576 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.41 ' C ' ' O ' ' A' ' 76' ' ' GLN . . . -39.31 -82.66 0.02 OUTLIER Glycine 0 N--CA 1.5 2.916 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.698 HD12 ' CD2' ' A' ' 70' ' ' HIS . 46.5 mt -109.84 32.96 4.67 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.514 -0.992 . . . . 0.0 108.854 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.42 76.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.519 -0.738 . . . . 0.0 109.315 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.92 -37.44 87.4 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.424 -0.797 . . . . 0.0 109.261 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.5 mt -86.8 -5.69 59.04 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.096 -1.002 . . . . 0.0 108.805 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.92 -1.489 . . . . 0.0 109.413 179.507 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.4 tpp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -84.9 143.45 29.01 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 110.156 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m -87.94 154.91 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-O 121.813 0.816 . . . . 0.0 110.631 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.29 146.77 31.1 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -102.83 136.9 41.8 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.741 0.781 . . . . 0.0 110.217 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -149.38 120.69 7.85 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.77 0.795 . . . . 0.0 109.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 48.98 30.84 2.96 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.741 0.781 . . . . 0.0 110.452 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.32 -20.26 41.85 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -81.02 144.16 31.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.341 -1.093 . . . . 0.0 110.299 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -104.32 139.07 39.83 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -115.01 137.57 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.648 0.737 . . . . 0.0 110.122 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -118.65 90.0 38.74 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.62 145.85 46.33 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.947 2.431 . . . . 0.0 112.907 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.28 -171.95 40.53 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -149.15 141.02 23.68 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.999 . . . . 0.0 109.773 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -170.02 155.74 5.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.587 -0.696 . . . . 0.0 109.514 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -105.3 137.9 42.36 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.861 0.838 . . . . 0.0 110.146 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.4 141.16 36.44 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.389 0.614 . . . . 0.0 109.585 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 37.4 p-10 -68.44 -8.28 39.3 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.756 0.789 . . . . 0.0 109.349 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -64.27 -42.44 96.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.392 -0.818 . . . . 0.0 109.205 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.412 ' O ' ' C ' ' A' ' 22' ' ' ARG . 1.1 pp -122.58 12.71 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ILE . 89.0 mtm180 38.48 34.62 0.08 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.632 0.729 . . . . 0.0 110.102 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -138.35 169.12 18.35 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.054 0.931 . . . . 0.0 110.359 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -85.3 135.37 33.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.635 0.731 . . . . 0.0 109.891 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -147.37 147.64 28.94 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.377 -0.827 . . . . 0.0 109.493 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -38.19 109.21 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 C-N-CA 122.685 2.257 . . . . 0.0 111.65 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -109.05 112.0 23.94 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.16 145.7 37.84 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.529 -0.732 . . . . 0.0 109.424 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.92 124.87 49.25 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -112.36 133.26 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-O 121.461 0.648 . . . . 0.0 109.797 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.99 138.33 43.89 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.613 0.721 . . . . 0.0 109.355 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -83.28 134.76 34.92 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.707 0.765 . . . . 0.0 110.267 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.1 t -70.61 134.25 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-O 121.732 0.777 . . . . 0.0 110.5 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.86 -14.26 31.84 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 108.707 -1.757 . . . . 0.0 108.707 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.442 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 15.6 m -153.28 53.53 1.01 Allowed Pre-proline 0 N--CA 1.49 1.546 0 O-C-N 121.237 -1.155 . . . . 0.0 109.636 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 42.8 Cg_endo -72.04 -10.74 26.47 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.643 2.228 . . . . 0.0 111.106 179.197 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -74.38 -4.42 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.486 -0.758 . . . . 0.0 109.051 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.515 ' NH1' ' O ' ' A' ' 81' ' ' LEU . 91.8 mtt180 -86.99 137.94 31.93 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.91 0.862 . . . . 0.0 110.607 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -52.36 121.77 22.28 Favored Pre-proline 0 N--CA 1.487 1.407 0 O-C-N 121.886 -0.509 . . . . 0.0 110.435 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.76 151.96 52.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.71 2.274 . . . . 0.0 112.984 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.509 HD11 ' HB2' ' A' ' 80' ' ' ASP . 4.2 mp -118.38 130.89 24.49 Favored Pre-proline 0 N--CA 1.495 1.78 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.04 145.98 45.88 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.523 2.148 . . . . 0.0 112.246 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.9 t -116.52 137.13 52.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.703 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -138.22 167.65 21.38 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.309 0.576 . . . . 0.0 109.666 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -126.83 145.21 52.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.48 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 81.6 Cg_exo -43.2 -26.31 0.82 Allowed 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.24 1.96 . . . . 0.0 111.574 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -69.73 160.4 31.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.744 . . . . 0.0 110.515 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 46' ' ' PRO . 73.2 m-85 -128.37 146.55 50.74 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.544 0.688 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.518 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 71.8 m-85 -148.55 121.91 9.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.469 -0.769 . . . . 0.0 109.877 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -82.59 -20.18 36.98 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -81.77 136.31 35.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.34 -0.85 . . . . 0.0 109.881 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.86 -40.58 72.23 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.61 0.719 . . . . 0.0 109.778 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.96 99.23 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.411 -0.806 . . . . 0.0 109.807 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.518 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 54.1 t0 -65.26 -39.63 92.9 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.41 -0.806 . . . . 0.0 109.906 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.1 95.0 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.261 -0.899 . . . . 0.0 109.839 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.94 -46.02 76.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.31 -0.869 . . . . 0.0 109.858 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.57 -44.3 91.12 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.236 -0.915 . . . . 0.0 109.95 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.3 t -66.83 -41.71 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.496 -0.752 . . . . 0.0 109.906 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 88.2 p -56.95 -41.28 78.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.325 -0.86 . . . . 0.0 109.989 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.12 -45.76 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.023 -1.048 . . . . 0.0 109.66 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.52 -53.72 26.17 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.271 -0.893 . . . . 0.0 109.929 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.7 m -62.95 -35.66 80.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.387 -0.821 . . . . 0.0 109.809 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.51 ' HB2' ' O ' ' A' ' 59' ' ' SER . . . -55.65 -43.26 76.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.165 -0.96 . . . . 0.0 108.818 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -63.16 -39.66 95.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 0.0 108.747 179.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -64.92 -43.62 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.308 -0.87 . . . . 0.0 108.736 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.0 mm -64.29 -43.93 97.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.725 0.774 . . . . 0.0 109.555 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -64.21 -44.24 97.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 O-C-N 121.464 -0.772 . . . . 0.0 109.4 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -64.88 -45.22 86.9 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.81 0.814 . . . . 0.0 109.554 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -62.78 -38.95 92.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.429 -0.794 . . . . 0.0 109.868 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.499 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 79.4 t60 -60.82 -40.95 94.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.21 -0.931 . . . . 0.0 109.852 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.09 -41.73 99.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.373 -0.829 . . . . 0.0 109.823 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -79.69 -63.73 1.35 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.16 -0.962 . . . . 0.0 108.991 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -171.17 132.61 0.82 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 109.493 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.419 ' CG ' ' N ' ' A' ' 75' ' ' ASP . 76.6 t60 -161.56 168.22 23.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.321 -0.862 . . . . 0.0 109.536 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.51 ' CG ' ' H ' ' A' ' 76' ' ' GLN . 43.9 t0 -84.24 -176.64 6.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.565 -0.71 . . . . 0.0 110.437 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.51 ' H ' ' CG ' ' A' ' 75' ' ' ASP . 17.0 tm0? -39.15 92.74 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.723 0.773 . . . . 0.0 110.495 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 75' ' ' ASP . . . -164.77 122.42 1.08 Allowed Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.3 mt 59.65 1.16 0.27 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.724 -0.868 . . . . 0.0 109.58 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.17 -34.46 78.13 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.483 -0.761 . . . . 0.0 109.431 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.509 ' HB2' HD11 ' A' ' 41' ' ' ILE . 98.5 m-20 -61.98 -41.05 97.6 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.251 -0.906 . . . . 0.0 109.794 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.515 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 57.0 mt -63.53 -40.32 96.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.301 -0.875 . . . . 0.0 109.477 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 -179.899 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.7 mmm . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.776 0.798 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 43.02 -100.12 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.658 0.742 . . . . 0.0 110.314 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.1 m -91.64 152.93 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.201 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.18 137.42 51.48 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.696 0.76 . . . . 0.0 109.792 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -82.25 151.2 26.92 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.614 0.721 . . . . 0.0 110.086 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -154.51 111.84 3.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.445 ' NH2' ' CD1' ' A' ' 71' ' ' LEU . 84.1 mtp180 49.75 35.59 9.33 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.69 0.757 . . . . 0.0 110.534 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.32 -5.76 83.87 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -105.41 137.34 43.37 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.239 -1.154 . . . . 0.0 110.252 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -89.22 144.85 25.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.746 -0.596 . . . . 0.0 109.461 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.74 130.04 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-O 121.424 0.63 . . . . 0.0 109.391 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.594 ' O ' ' HB1' ' A' ' 28' ' ' ALA . 49.6 tt0 -121.26 117.95 30.27 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.98 154.22 42.44 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.609 2.206 . . . . 0.0 113.023 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.43 -167.3 39.2 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -151.07 156.01 40.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.511 -0.993 . . . . 0.0 109.509 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 57.4 tt0 -152.98 154.1 34.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.544 -0.723 . . . . 0.0 109.08 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -107.95 123.92 49.36 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.777 0.799 . . . . 0.0 110.159 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -96.92 138.3 34.68 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.797 0.808 . . . . 0.0 109.41 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -86.94 -24.29 24.82 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 109.41 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.32 -44.91 93.6 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.432 -0.793 . . . . 0.0 109.543 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.433 ' O ' ' C ' ' A' ' 22' ' ' ARG . 19.7 pt -105.6 9.99 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.449 -0.782 . . . . 0.0 108.994 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.433 ' C ' ' O ' ' A' ' 21' ' ' ILE . 51.8 ptt85 35.8 41.78 0.12 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.655 0.741 . . . . 0.0 110.803 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -146.71 160.63 41.99 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.312 -0.868 . . . . 0.0 110.427 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -85.54 137.48 32.85 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 121.536 0.684 . . . . 0.0 109.854 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.3 m -139.39 151.63 67.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.673 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -45.42 134.3 12.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.429 2.086 . . . . 0.0 112.223 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 71.9 t80 -140.31 113.81 8.64 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.378 -0.826 . . . . 0.0 109.56 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.594 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -138.69 151.12 46.89 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.584 0.707 . . . . 0.0 109.267 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.8 mt -101.74 128.34 48.11 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.481 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 95.1 mt -108.62 129.55 62.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.718 ' NE ' HH22 ' A' ' 38' ' ' ARG . 9.4 mmm180 -117.04 136.11 53.21 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.717 0.77 . . . . 0.0 109.356 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -101.89 117.91 35.83 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.759 0.79 . . . . 0.0 109.323 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 6.4 t -77.54 118.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-O 121.606 0.717 . . . . 0.0 109.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 133.34 -24.9 3.69 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.464 ' O ' ' O ' ' A' ' 36' ' ' PRO . 3.3 m -104.15 127.55 28.97 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.367 -1.078 . . . . 0.0 110.349 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.464 ' O ' ' O ' ' A' ' 35' ' ' VAL . 50.8 Cg_exo -50.38 -161.09 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.561 2.174 . . . . 0.0 112.791 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.79 144.61 56.35 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.743 0.783 . . . . 0.0 110.641 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.718 HH22 ' NE ' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -160.96 -172.57 3.52 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.812 0.815 . . . . 0.0 110.362 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.5 m -84.73 131.79 48.42 Favored Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.672 -0.643 . . . . 0.0 109.613 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.58 131.75 17.86 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.509 2.139 . . . . 0.0 112.623 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.49 106.63 52.23 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.783 -0.573 . . . . 0.0 109.583 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.478 ' CB ' ' CE1' ' A' ' 27' ' ' TYR . 59.4 Cg_endo -75.6 146.73 30.89 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.472 2.114 . . . . 0.0 112.242 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.15 132.37 53.68 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.612 0.72 . . . . 0.0 109.715 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 p -136.41 167.13 21.91 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.389 0.614 . . . . 0.0 109.605 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -131.65 142.14 44.2 Favored Pre-proline 0 N--CA 1.492 1.657 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -45.98 -35.26 14.03 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.197 1.931 . . . . 0.0 111.576 178.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.48 144.67 56.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.52 -0.738 . . . . 0.0 110.01 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -125.51 148.11 49.0 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.66 0.743 . . . . 0.0 109.847 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.67 129.85 33.39 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.745 0.783 . . . . 0.0 109.497 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 64.7 t0 -66.86 -35.66 80.54 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.563 0.697 . . . . 0.0 109.523 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 72.4 mt -75.21 135.41 41.03 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.953 0.882 . . . . 0.0 110.342 -179.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 56' ' ' GLU . 1.7 tm-20 -72.47 -40.05 67.25 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.717 0.77 . . . . 0.0 109.715 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.2 96.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.394 -0.816 . . . . 0.0 109.872 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -64.17 -36.49 84.21 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.323 -0.86 . . . . 0.0 109.25 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.64 89.68 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.403 -0.811 . . . . 0.0 109.182 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 52' ' ' GLU . 97.2 mt-10 -64.39 -45.3 88.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.433 -0.792 . . . . 0.0 109.491 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -64.32 -43.86 93.37 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.375 -0.828 . . . . 0.0 109.677 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.3 -41.55 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.495 -0.753 . . . . 0.0 109.577 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 95.3 p -57.53 -40.38 78.68 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.409 -0.807 . . . . 0.0 109.686 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.78 -46.07 93.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.187 -0.946 . . . . 0.0 109.471 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.75 -52.64 41.91 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.118 -0.988 . . . . 0.0 109.4 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 92.6 m -59.53 -40.28 86.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.314 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 59' ' ' SER . . . -52.97 -40.13 63.5 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.559 -0.713 . . . . 0.0 109.69 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -61.51 -41.18 96.92 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.222 -0.924 . . . . 0.0 109.311 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.527 HD12 ' N ' ' A' ' 65' ' ' ILE . 1.4 mp -63.92 -43.85 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.26 -0.9 . . . . 0.0 109.542 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.89 -43.22 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.26 -0.9 . . . . 0.0 109.131 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.3 mt -62.77 -43.78 99.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.213 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -64.32 -43.73 93.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.399 -0.813 . . . . 0.0 109.395 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.515 ' O ' ' N ' ' A' ' 73' ' ' ARG . 15.8 m -63.57 -35.92 82.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.443 -0.785 . . . . 0.0 109.389 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.527 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 64.0 t60 -58.83 -42.86 90.25 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.365 -0.834 . . . . 0.0 109.621 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.445 ' CD1' ' NH2' ' A' ' 7' ' ' ARG . 96.3 mt -63.72 -41.25 98.11 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.356 -0.84 . . . . 0.0 109.093 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -85.51 -70.59 0.58 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 109.229 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' SER . 85.9 mtp180 -79.78 145.34 32.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.384 -0.823 . . . . 0.0 110.439 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -124.2 28.69 6.64 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.615 ' C ' ' H ' ' A' ' 77' ' ' GLY . 98.1 m-20 -84.59 89.66 7.5 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.359 -0.838 . . . . 0.0 109.74 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 64.54 -24.76 0.08 Allowed 'General case' 0 N--CA 1.501 2.079 0 CA-C-O 121.428 0.632 . . . . 0.0 110.268 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.615 ' H ' ' C ' ' A' ' 75' ' ' ASP . . . -51.68 109.29 0.78 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 77' ' ' GLY . 47.5 mt 37.63 34.59 0.05 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.83 0.824 . . . . 0.0 109.575 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.97 85.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.498 -0.751 . . . . 0.0 109.741 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -64.82 -35.43 81.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.213 -0.93 . . . . 0.0 109.186 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.499 HD22 ' NE ' ' A' ' 38' ' ' ARG . 82.4 mt -82.96 -4.41 58.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.209 -0.932 . . . . 0.0 109.257 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.468 0 CA-C-O 117.881 -1.51 . . . . 0.0 109.566 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.488 ' O ' ' N ' ' A' ' 3' ' ' VAL . 88.9 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 1' ' ' MET . 99.6 m-20 40.79 -93.57 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.636 -0.665 . . . . 0.0 110.578 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.488 ' N ' ' O ' ' A' ' 1' ' ' MET . 29.0 m -111.48 131.45 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.579 -0.7 . . . . 0.0 109.491 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.92 159.33 15.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.435 -0.791 . . . . 0.0 109.248 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -109.73 143.45 39.51 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.471 -0.768 . . . . 0.0 109.556 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -152.83 124.38 7.74 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.296 -0.878 . . . . 0.0 109.308 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 53.74 26.04 5.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.621 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.31 2.24 87.76 Favored Glycine 0 N--CA 1.495 2.619 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.94 140.58 38.73 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.35 -1.088 . . . . 0.0 109.554 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.514 -0.741 . . . . 0.0 109.41 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -124.76 130.01 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -114.98 113.29 44.19 Favored Pre-proline 0 N--CA 1.497 1.925 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.82 157.34 47.82 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.815 1.677 . . . . 0.0 112.79 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.7 -163.78 37.48 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -148.92 146.3 27.81 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.065 -1.256 . . . . 0.0 109.511 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.48 ' CD ' ' N ' ' A' ' 17' ' ' TYR . 6.5 tm0? -167.61 147.29 5.06 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.31 -0.868 . . . . 0.0 109.087 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.48 ' N ' ' CD ' ' A' ' 16' ' ' GLN . 49.5 p90 -107.63 137.86 44.9 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.4 mtp180 -89.04 136.04 33.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.929 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -71.07 -18.99 62.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -62.21 -45.46 93.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.322 -0.861 . . . . 0.0 109.744 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.11 -2.36 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 48.32 50.27 16.73 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.582 -0.699 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -139.55 157.28 46.08 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.408 -0.808 . . . . 0.0 109.07 178.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -85.73 131.66 34.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.626 -0.672 . . . . 0.0 109.78 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.0 148.75 36.63 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.252 -0.905 . . . . 0.0 109.344 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.74 110.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.325 2.016 . . . . 0.0 111.608 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -108.07 113.2 26.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.153 -0.967 . . . . 0.0 109.234 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.55 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -137.49 154.3 49.91 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.4 -0.813 . . . . 0.0 108.858 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.7 mt -109.69 129.64 55.59 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.6 mt -107.23 128.64 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.683 -0.636 . . . . 0.0 109.399 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -130.43 138.48 50.34 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -82.41 137.98 34.56 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.405 -0.81 . . . . 0.0 109.498 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.1 t -69.28 101.91 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.403 -0.811 . . . . 0.0 109.851 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 137.23 -21.65 3.28 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.412 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 15.9 m -152.04 55.12 1.45 Allowed Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.153 -1.204 . . . . 0.0 109.959 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 57.6 Cg_endo -72.28 -11.64 26.97 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.354 2.036 . . . . 0.0 111.36 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -74.87 -2.85 28.66 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.439 -0.788 . . . . 0.0 109.534 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.446 ' O ' ' C ' ' A' ' 39' ' ' THR . 24.1 mmm180 -81.18 132.65 35.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.173 -0.954 . . . . 0.0 109.197 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.446 ' C ' ' O ' ' A' ' 38' ' ' ARG . 88.6 m -33.67 97.61 0.12 Allowed Pre-proline 0 N--CA 1.5 2.047 0 O-C-N 122.113 -0.367 . . . . 0.0 110.147 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.63 143.42 68.91 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.124 1.882 . . . . 0.0 112.326 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 24.2 mm -106.01 130.76 22.48 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.313 -0.867 . . . . 0.0 108.734 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.2 148.49 39.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.763 1.642 . . . . 0.0 112.121 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.55 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 10.2 t -120.43 133.58 55.4 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.3 p -136.19 167.75 20.69 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -128.33 143.72 49.18 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.542 -0.724 . . . . 0.0 109.388 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -44.04 -27.36 1.75 Allowed 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 121.939 1.759 . . . . 0.0 112.008 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.24 165.01 14.67 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.396 -0.815 . . . . 0.0 109.917 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -128.4 148.06 50.68 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -150.61 110.88 4.17 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.084 -1.01 . . . . 0.0 109.667 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 68.3 t0 -66.69 -33.58 75.95 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.692 -0.63 . . . . 0.0 109.938 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.0 mt -79.35 138.19 37.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.165 -0.96 . . . . 0.0 110.953 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -70.74 -36.88 73.36 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.567 0.699 . . . . 0.0 109.416 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.29 -49.26 77.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.91 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.59 -36.18 83.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.381 -0.824 . . . . 0.0 108.938 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.25 97.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.33 -0.856 . . . . 0.0 109.563 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.16 -50.02 65.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.271 -0.893 . . . . 0.0 110.194 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -62.92 -44.57 95.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.281 -0.887 . . . . 0.0 109.647 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.28 -42.39 93.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.351 -0.843 . . . . 0.0 109.733 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.532 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 93.8 p -55.82 -40.51 72.87 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.711 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.403 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.4 mt -64.3 -45.32 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.053 -1.029 . . . . 0.0 109.457 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.31 -49.19 62.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.351 -0.843 . . . . 0.0 109.681 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.9 m -62.91 -34.79 78.18 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.529 -0.732 . . . . 0.0 109.436 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.8 -41.8 92.02 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.377 -0.827 . . . . 0.0 109.353 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.403 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 64.7 mttp -62.92 -44.7 95.37 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.197 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.59 -43.51 86.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.481 -0.762 . . . . 0.0 109.21 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.1 mm -62.31 -44.74 99.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.55 -45.05 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.035 -1.041 . . . . 0.0 109.603 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -67.08 -51.59 52.48 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.863 . . . . 0.0 109.741 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.505 ' O ' ' N ' ' A' ' 73' ' ' ARG . 58.9 m -62.09 -41.45 98.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 109.349 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.505 ' CE1' ' HB2' ' A' ' 78' ' ' LEU . 18.6 t-80 -53.19 -43.79 67.43 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.376 -0.827 . . . . 0.0 109.432 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.4 mt -62.61 -42.03 99.33 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.352 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -98.99 16.85 21.2 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.36 -0.837 . . . . 0.0 109.997 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 69' ' ' SER . 71.4 ttt180 -159.35 125.38 4.38 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.205 -0.934 . . . . 0.0 110.134 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.405 ' O ' ' O ' ' A' ' 73' ' ' ARG . 11.0 m-70 44.57 94.43 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.549 -0.72 . . . . 0.0 110.334 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -81.58 -5.37 57.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.256 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.406 ' O ' ' O ' ' A' ' 77' ' ' GLY . 6.8 tm0? -67.11 -35.45 79.8 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.886 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . -44.45 -97.21 0.01 OUTLIER Glycine 0 N--CA 1.493 2.452 0 O-C-N 121.358 -0.839 . . . . 0.0 111.227 -178.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.505 ' HB2' ' CE1' ' A' ' 70' ' ' HIS . 45.8 mt -73.61 37.03 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.129 -1.218 . . . . 0.0 110.21 -178.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -65.44 -35.62 81.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.362 -0.837 . . . . 0.0 109.768 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -62.57 -35.44 79.52 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.383 -0.823 . . . . 0.0 108.986 -179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.24 -2.64 53.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.409 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.584 179.734 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.408 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -149.97 19.92 0.88 Allowed 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 m -82.57 154.83 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.56 138.23 50.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.586 0.708 . . . . 0.0 109.478 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -91.67 138.91 31.18 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.524 0.678 . . . . 0.0 110.04 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -149.4 121.87 8.51 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.532 -0.73 . . . . 0.0 109.608 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 52.89 29.17 7.36 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.623 0.725 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.97 1.37 88.83 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -105.06 139.86 39.1 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.458 -1.025 . . . . 0.0 109.895 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -87.4 139.67 30.32 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.9 mt -123.16 129.83 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 121.387 0.613 . . . . 0.0 109.463 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -121.05 92.46 48.51 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.68 148.35 22.76 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.759 2.306 . . . . 0.0 112.801 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.95 161.83 29.77 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -93.88 124.98 38.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.642 -0.917 . . . . 0.0 109.921 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -149.4 153.53 37.51 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.613 -0.679 . . . . 0.0 109.514 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -108.32 136.74 47.46 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.614 0.721 . . . . 0.0 109.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -96.39 138.74 33.53 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.631 0.729 . . . . 0.0 109.756 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.72 -24.59 65.39 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.542 0.687 . . . . 0.0 109.804 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -61.09 -45.1 96.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 110.335 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.9 pt -110.25 -5.07 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.404 -0.81 . . . . 0.0 109.313 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 49.14 42.23 20.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.658 0.742 . . . . 0.0 109.873 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -144.57 165.4 28.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 110.098 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -85.26 128.31 34.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.619 0.723 . . . . 0.0 110.043 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.7 m -146.82 148.07 31.85 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.531 -0.73 . . . . 0.0 109.192 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -40.93 110.31 0.12 Allowed 'Trans proline' 0 C--N 1.315 -1.223 0 C-N-CA 122.503 2.135 . . . . 0.0 112.091 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.415 ' OH ' HD21 ' A' ' 29' ' ' LEU . 82.1 t80 -114.59 119.87 38.24 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.722 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -138.67 145.05 39.94 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.61 -0.681 . . . . 0.0 109.259 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.415 HD21 ' OH ' ' A' ' 27' ' ' TYR . 64.4 mt -106.27 131.93 52.91 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -114.7 127.46 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 CA-C-O 121.374 0.607 . . . . 0.0 109.487 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -134.26 133.97 41.4 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.451 0.643 . . . . 0.0 109.267 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -81.97 137.63 35.1 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.643 0.735 . . . . 0.0 110.15 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.0 t -68.56 133.3 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.607 0.717 . . . . 0.0 110.192 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.413 ' O ' HG13 ' A' ' 35' ' ' VAL . . . 103.16 -22.86 35.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.413 HG13 ' O ' ' A' ' 34' ' ' GLY . 19.1 m -154.85 54.7 1.07 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.28 -1.129 . . . . 0.0 110.32 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.41 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 58.4 Cg_endo -72.31 -12.74 27.78 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.529 2.153 . . . . 0.0 110.916 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -87.39 40.17 0.91 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.6 -0.688 . . . . 0.0 109.908 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -114.12 55.53 0.73 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.487 -0.758 . . . . 0.0 109.348 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m 43.15 82.59 0.22 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.966 -0.459 . . . . 0.0 109.775 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.59 143.66 77.96 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.77 2.313 . . . . 0.0 112.528 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.5 ' N ' HD12 ' A' ' 41' ' ' ILE . 3.7 mp -116.38 130.96 24.09 Favored Pre-proline 0 N--CA 1.491 1.593 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.51 149.01 38.54 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.469 2.113 . . . . 0.0 112.461 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.722 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.5 OUTLIER -111.09 133.01 53.79 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -134.85 162.06 33.47 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.611 0.72 . . . . 0.0 109.574 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.623 ' O ' ' N ' ' A' ' 47' ' ' GLU . 12.9 t80 -143.15 135.25 13.19 Favored Pre-proline 0 N--CA 1.487 1.416 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -43.29 76.73 0.01 OUTLIER 'Trans proline' 0 N--CA 1.499 1.797 0 C-N-CA 122.857 2.371 . . . . 0.0 112.207 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.623 ' N ' ' O ' ' A' ' 45' ' ' TYR . 71.1 mm-40 -148.91 148.39 29.78 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.481 -0.762 . . . . 0.0 109.387 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -127.31 118.91 25.1 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -140.51 131.1 25.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.636 -0.665 . . . . 0.0 109.812 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -91.35 -25.43 19.4 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -76.16 143.6 41.06 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.64 0.733 . . . . 0.0 109.972 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -73.1 -40.64 64.82 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.43 0.633 . . . . 0.0 110.176 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.05 92.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.368 -0.832 . . . . 0.0 109.853 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.11 -42.49 96.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.359 -0.838 . . . . 0.0 109.839 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.76 -43.57 88.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.387 -0.821 . . . . 0.0 109.825 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.99 -44.89 75.58 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.804 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -63.85 -45.56 88.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.477 -0.765 . . . . 0.0 109.725 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.13 -42.16 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.579 -0.7 . . . . 0.0 109.777 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.416 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 77.9 p -54.73 -41.62 70.58 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.442 -0.786 . . . . 0.0 109.856 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.66 -44.62 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 109.481 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.09 91.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.391 -0.818 . . . . 0.0 109.654 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.35 -46.41 73.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.326 -0.859 . . . . 0.0 109.701 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.37 -43.41 44.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.438 -0.789 . . . . 0.0 109.502 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.74 -42.59 97.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.577 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.3 -44.64 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.387 -0.821 . . . . 0.0 109.997 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.2 -44.59 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.489 -0.757 . . . . 0.0 109.314 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.4 mt -64.7 -44.33 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -66.15 -44.22 84.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.505 -0.747 . . . . 0.0 109.906 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 73' ' ' ARG . 43.3 t -65.66 -40.36 92.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.358 -0.839 . . . . 0.0 110.1 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -59.23 -42.1 90.25 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.903 . . . . 0.0 109.673 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.8 -42.97 99.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.445 -0.784 . . . . 0.0 109.858 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -84.1 -19.94 33.42 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.382 -0.824 . . . . 0.0 109.584 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 69' ' ' SER . 84.8 mtt85 -141.68 93.45 2.56 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.304 -0.873 . . . . 0.0 109.364 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.445 ' O ' ' N ' ' A' ' 76' ' ' GLN . 93.6 m-70 -57.38 -44.54 84.56 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.615 -0.678 . . . . 0.0 109.214 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' HIS . 98.2 m-20 36.42 -96.75 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.677 0.751 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 74' ' ' HIS . 12.0 tp-100 -169.62 97.06 0.31 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.458 -0.776 . . . . 0.0 109.324 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -75.0 0.02 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -102.91 17.1 24.79 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.377 -1.072 . . . . 0.0 109.682 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.49 -28.3 69.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.323 -0.86 . . . . 0.0 109.335 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.456 ' HB3' HD11 ' A' ' 41' ' ' ILE . 68.0 t0 -64.16 -32.96 74.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.535 -0.728 . . . . 0.0 109.518 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.6 mt -79.59 -3.94 49.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.37 -0.831 . . . . 0.0 109.797 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.019 -1.434 . . . . 0.0 109.744 179.908 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -65.11 -39.98 93.88 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.58 0.705 . . . . 0.0 109.512 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.2 m -86.71 133.83 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.357 -0.839 . . . . 0.0 110.224 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.68 159.58 15.15 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.525 0.679 . . . . 0.0 109.775 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -111.64 152.98 27.03 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.738 0.78 . . . . 0.0 110.239 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -139.94 -134.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.671 0.748 . . . . 0.0 109.934 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -72.65 51.99 0.28 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.754 0.788 . . . . 0.0 110.067 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.87 -6.86 82.64 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -105.99 138.7 41.72 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.339 -1.095 . . . . 0.0 110.34 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -85.6 144.7 27.73 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.359 0.599 . . . . 0.0 109.498 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.9 mt -125.32 132.1 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 121.5 0.667 . . . . 0.0 109.877 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -126.03 124.29 24.63 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.1 157.18 38.25 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.608 2.205 . . . . 0.0 112.729 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.69 -169.32 42.26 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.509 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 47.4 p-80 -148.76 146.85 28.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.768 -0.842 . . . . 0.0 109.767 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -169.78 151.35 4.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -109.3 142.95 39.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 121.887 0.851 . . . . 0.0 110.261 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -94.58 136.23 35.12 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.869 0.843 . . . . 0.0 109.477 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 42.3 p30 -68.0 -20.0 64.98 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.424 0.631 . . . . 0.0 109.673 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 98.9 m-20 -62.38 -42.16 99.2 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.5 -0.75 . . . . 0.0 109.639 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.2 pt -115.56 -3.13 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.573 -0.704 . . . . 0.0 109.281 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 49.16 40.54 17.92 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.632 -0.667 . . . . 0.0 109.988 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -135.83 161.16 36.39 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.651 0.739 . . . . 0.0 110.38 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -86.44 128.33 34.94 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 121.574 0.702 . . . . 0.0 109.85 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -137.3 147.6 58.8 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.97 108.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.248 0 C-N-CA 122.631 2.221 . . . . 0.0 112.057 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -106.33 116.97 32.85 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.487 0.66 . . . . 0.0 109.645 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.733 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -135.11 141.78 46.08 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.681 0.753 . . . . 0.0 109.079 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.2 mt -105.08 127.08 52.72 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.65 0.738 . . . . 0.0 109.309 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -115.16 130.46 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.458 0.647 . . . . 0.0 109.465 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.96 134.85 47.72 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.912 0.863 . . . . 0.0 109.672 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -82.6 137.33 34.56 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.872 0.844 . . . . 0.0 110.202 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.9 t -69.13 132.64 32.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.676 0.751 . . . . 0.0 110.199 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.89 -25.11 25.01 Favored Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -152.73 66.89 6.41 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.384 -1.068 . . . . 0.0 109.852 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.4 ' O ' ' O ' ' A' ' 37' ' ' ASP . 36.8 Cg_exo -57.24 -35.08 98.84 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.41 2.073 . . . . 0.0 111.028 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.574 ' C ' ' H ' ' A' ' 39' ' ' THR . 82.8 m-20 -61.05 -127.63 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.41 0.624 . . . . 0.0 110.228 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.534 ' NE ' ' O ' ' A' ' 80' ' ' ASP . 83.3 mtp180 57.33 2.2 0.13 Allowed 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.567 0.699 . . . . 0.0 109.521 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.574 ' H ' ' C ' ' A' ' 37' ' ' ASP . 1.3 m 77.55 101.65 0.03 OUTLIER Pre-proline 0 C--N 1.293 -1.877 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.64 145.53 29.86 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.18 1.92 . . . . 0.0 112.427 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.9 mm -114.82 95.39 41.04 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.17 142.94 43.91 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.7 2.267 . . . . 0.0 112.447 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.733 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -107.74 138.38 44.09 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.692 0.758 . . . . 0.0 110.102 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.2 p -139.24 166.65 23.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.497 0.665 . . . . 0.0 109.48 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.59 ' O ' ' N ' ' A' ' 47' ' ' GLU . 39.9 t80 -137.66 138.29 23.9 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.33 72.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.776 0 C-N-CA 122.863 2.375 . . . . 0.0 112.337 178.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.59 ' N ' ' O ' ' A' ' 45' ' ' TYR . 17.3 pt-20 -173.06 143.45 1.15 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.393 -0.817 . . . . 0.0 109.313 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -125.2 149.61 47.78 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.678 0.752 . . . . 0.0 109.832 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -137.77 131.3 31.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.609 0.719 . . . . 0.0 109.6 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -74.1 -16.4 61.02 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -96.6 130.56 43.77 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.791 0.805 . . . . 0.0 109.443 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.509 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 83.3 tt0 -69.02 -37.36 78.6 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.262 0.553 . . . . 0.0 110.397 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.84 95.1 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.188 -0.945 . . . . 0.0 109.649 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.96 -39.84 95.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.538 -0.726 . . . . 0.0 109.432 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.79 -40.02 94.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.531 -0.731 . . . . 0.0 109.788 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.05 -48.43 68.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.441 -0.787 . . . . 0.0 110.016 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.8 ttp85 -64.11 -44.55 91.92 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.766 0.793 . . . . 0.0 109.767 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.37 -41.9 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.579 -0.7 . . . . 0.0 109.659 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.656 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 78.3 p -57.9 -40.15 79.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.46 -0.775 . . . . 0.0 109.681 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.17 -44.17 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 109.244 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.72 82.55 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.68 0.752 . . . . 0.0 109.405 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.512 ' SG ' ' N ' ' A' ' 63' ' ' ALA . 1.2 p -66.13 -36.96 84.51 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.821 0.82 . . . . 0.0 109.373 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.512 ' N ' ' SG ' ' A' ' 62' ' ' CYS . . . -60.89 -44.83 96.58 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.528 0.68 . . . . 0.0 109.473 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.96 -42.51 97.26 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.607 0.718 . . . . 0.0 109.513 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.48 -43.18 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.555 -0.716 . . . . 0.0 109.736 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.78 -43.22 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.353 -0.842 . . . . 0.0 109.652 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.4 -44.12 98.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.576 -0.703 . . . . 0.0 109.432 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -67.8 -40.54 83.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.358 -0.838 . . . . 0.0 109.314 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 73' ' ' ARG . 66.8 m -63.43 -42.22 98.7 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.619 -0.675 . . . . 0.0 110.098 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.75 -47.34 85.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.251 -0.905 . . . . 0.0 109.811 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.95 -41.45 95.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.523 -0.736 . . . . 0.0 109.412 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -90.83 -77.13 0.42 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 109.967 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 69' ' ' SER . 60.9 ttm-85 -65.0 -106.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.607 -0.683 . . . . 0.0 110.176 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.667 ' CE1' ' H ' ' A' ' 76' ' ' GLN . 47.6 t-80 -178.97 -100.47 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 121.504 0.669 . . . . 0.0 109.197 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.579 ' N ' ' ND1' ' A' ' 74' ' ' HIS . 99.6 m-20 55.33 33.13 20.11 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-O 121.744 0.783 . . . . 0.0 109.378 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.667 ' H ' ' CE1' ' A' ' 74' ' ' HIS . 43.1 tt0 46.16 -128.15 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.765 0.793 . . . . 0.0 110.024 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.523 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . 59.1 139.85 0.01 OUTLIER Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.2 mt 60.65 0.0 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.712 0.768 . . . . 0.0 109.244 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.523 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.44 -39.71 94.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.481 -0.762 . . . . 0.0 109.458 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.534 ' O ' ' NE ' ' A' ' 38' ' ' ARG . 97.6 m-20 -69.87 -19.48 63.43 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.491 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 78.1 mt -94.38 1.29 55.86 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.459 ' N ' ' NH2' ' A' ' 38' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.553 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ttt . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -78.52 -78.26 0.15 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.536 -0.727 . . . . 0.0 109.538 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m -85.89 155.05 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.677 0.751 . . . . 0.0 110.379 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.75 135.14 54.96 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.879 0.847 . . . . 0.0 109.965 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -88.14 136.79 32.81 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.726 0.774 . . . . 0.0 110.035 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -149.8 125.02 10.1 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.748 0.785 . . . . 0.0 109.569 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.539 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 23.6 mmt85 54.18 25.8 6.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.42 0.628 . . . . 0.0 109.867 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.72 3.62 83.43 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -107.63 141.24 39.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.859 0.837 . . . . 0.0 110.307 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.6 144.85 27.64 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.8 mt -124.0 129.4 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.714 0.769 . . . . 0.0 110.013 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -129.61 96.54 26.76 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.41 159.63 32.57 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.956 2.438 . . . . 0.0 113.118 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.32 126.86 0.94 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.629 ' NE2' ' CD2' ' A' ' 24' ' ' TYR . 0.3 OUTLIER -67.81 140.74 56.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.639 -0.918 . . . . 0.0 109.987 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.596 ' N ' ' ND1' ' A' ' 15' ' ' HIS . 58.6 tt0 -165.18 150.96 9.68 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 121.815 0.817 . . . . 0.0 109.753 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.55 137.67 40.48 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.793 0.806 . . . . 0.0 109.79 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp85 -97.64 135.73 39.03 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.902 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.0 p-10 -71.86 -18.06 62.09 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.93 -42.29 97.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.699 -0.626 . . . . 0.0 109.436 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 pt -113.57 -7.59 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 51.32 51.3 17.16 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.493 0.663 . . . . 0.0 109.608 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -146.48 169.67 18.43 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.932 0.872 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.629 ' CD2' ' NE2' ' A' ' 15' ' ' HIS . 3.2 m-85 -86.51 124.23 32.6 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.746 0.784 . . . . 0.0 109.314 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.45 155.45 39.18 Favored Pre-proline 0 C--N 1.302 -1.464 0 CA-C-O 121.241 0.544 . . . . 0.0 109.713 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.4 ' CB ' ' OG ' ' A' ' 59' ' ' SER . 19.4 Cg_endo -59.33 136.66 73.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.414 2.076 . . . . 0.0 111.726 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -138.52 116.87 11.94 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.409 0.623 . . . . 0.0 109.39 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -133.52 153.99 51.19 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.727 0.775 . . . . 0.0 110.206 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.8 mt -107.94 131.18 54.81 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.732 0.777 . . . . 0.0 109.845 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 89.3 mt -108.85 128.01 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 CA-C-O 121.716 0.77 . . . . 0.0 109.446 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -135.67 134.96 39.73 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.734 0.778 . . . . 0.0 109.836 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -86.83 134.87 33.51 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.751 0.786 . . . . 0.0 109.994 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 78.7 t -66.47 133.94 30.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.749 0.785 . . . . 0.0 110.503 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 17.82 61.17 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.9 t -146.41 64.38 9.56 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.617 -0.931 . . . . 0.0 109.805 179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.41 ' O ' ' C ' ' A' ' 37' ' ' ASP . 70.5 Cg_endo -78.75 -170.91 1.09 Allowed 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.868 2.378 . . . . 0.0 112.423 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 36' ' ' PRO . 65.5 t0 37.56 89.34 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.656 0.741 . . . . 0.0 110.569 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.878 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -167.3 -174.37 2.56 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 121.712 0.768 . . . . 0.0 110.009 -179.807 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.5 m -82.62 130.2 59.51 Favored Pre-proline 0 N--CA 1.483 1.179 0 O-C-N 121.885 -0.51 . . . . 0.0 109.628 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.24 133.4 21.06 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.445 2.096 . . . . 0.0 112.349 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 35.5 mm -115.9 84.48 13.25 Favored Pre-proline 0 N--CA 1.495 1.803 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -70.32 144.57 51.45 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 122.539 2.159 . . . . 0.0 112.55 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.7 t -105.39 135.27 47.08 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.902 0.858 . . . . 0.0 109.757 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 166.73 22.37 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.701 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.456 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.1 OUTLIER -126.03 146.93 57.4 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -70.62 -12.08 30.71 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 122.628 2.218 . . . . 0.0 111.513 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -78.01 -178.1 5.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.607 -0.683 . . . . 0.0 110.021 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -130.44 147.58 52.16 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.903 0.859 . . . . 0.0 109.984 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -149.34 98.24 2.77 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.615 0.722 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -71.26 -17.3 62.49 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.1 mt -91.27 132.34 36.2 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.807 0.813 . . . . 0.0 109.754 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -67.83 -39.51 83.89 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.8 75.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.683 -0.636 . . . . 0.0 109.927 -179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.84 -38.67 91.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.536 -0.728 . . . . 0.0 109.236 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.92 98.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.754 -0.591 . . . . 0.0 109.419 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -68.14 -47.09 69.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.747 -0.596 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -64.51 -44.05 92.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.604 -0.685 . . . . 0.0 109.665 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.434 HG12 ' SG ' ' A' ' 62' ' ' CYS . 69.7 t -67.76 -40.74 84.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.682 -0.636 . . . . 0.0 109.344 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.4 ' OG ' ' CB ' ' A' ' 26' ' ' PRO . 64.1 m -54.47 -44.81 72.92 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.543 -0.723 . . . . 0.0 109.684 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.596 -0.69 . . . . 0.0 109.375 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.19 95.02 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.767 -0.583 . . . . 0.0 109.757 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.456 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 86.5 m -67.6 -49.4 63.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.515 -0.741 . . . . 0.0 109.602 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.38 15.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.642 -0.661 . . . . 0.0 109.585 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -65.23 -41.22 94.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.735 -0.603 . . . . 0.0 109.445 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.52 -43.75 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.619 -0.676 . . . . 0.0 109.948 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.03 -44.63 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.99 -44.54 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.602 -0.687 . . . . 0.0 109.449 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.539 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 93.0 m-20 -66.32 -43.73 85.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.473 -0.767 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 73' ' ' ARG . 76.3 p -65.78 -37.46 86.38 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -58.48 -40.71 83.49 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.2 mt -63.84 -41.44 97.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.735 -0.603 . . . . 0.0 109.422 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -102.14 -72.7 0.68 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.652 -0.655 . . . . 0.0 109.742 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 69' ' ' SER . 83.8 mtp180 -87.58 -157.16 0.38 Allowed 'General case' 0 N--CA 1.497 1.904 0 CA-C-O 121.673 0.749 . . . . 0.0 110.446 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.412 ' C ' ' O ' ' A' ' 73' ' ' ARG . 59.3 t-80 38.43 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.565 0.698 . . . . 0.0 110.197 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' GLN . 83.6 m-20 -70.31 142.37 52.23 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.57 0.7 . . . . 0.0 109.523 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.425 ' O ' ' O ' ' A' ' 75' ' ' ASP . 50.2 tt0 57.83 152.09 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.797 0.808 . . . . 0.0 110.395 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 151.54 -65.6 0.36 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 86.6 mt -95.83 12.1 31.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.339 -1.095 . . . . 0.0 108.801 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.73 -39.58 94.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.775 -0.578 . . . . 0.0 109.49 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -65.38 -35.72 81.82 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.477 -0.764 . . . . 0.0 109.0 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 87.2 mt -86.22 -5.2 59.24 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.806 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 -179.687 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -116.12 47.75 1.35 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.567 -0.708 . . . . 0.0 109.188 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.17 136.79 24.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.371 -0.83 . . . . 0.0 109.621 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.89 163.71 13.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.109 -0.995 . . . . 0.0 109.528 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -118.65 144.47 46.15 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.677 -0.64 . . . . 0.0 109.471 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -153.04 119.85 5.71 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.276 -0.89 . . . . 0.0 109.713 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 52.28 31.06 8.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.468 -0.77 . . . . 0.0 110.151 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.67 3.32 83.84 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 120.142 -1.028 . . . . 0.0 110.663 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -106.26 136.26 46.3 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.238 -1.154 . . . . 0.0 109.52 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -91.17 145.64 24.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.273 -0.892 . . . . 0.0 108.984 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.1 mt -118.72 128.64 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.684 -0.635 . . . . 0.0 109.709 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -123.8 94.16 46.32 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.08 162.14 32.01 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.868 1.712 . . . . 0.0 112.76 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.533 ' O ' ' ND1' ' A' ' 15' ' ' HIS . . . 179.5 -25.1 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.533 ' ND1' ' O ' ' A' ' 14' ' ' GLY . 0.1 OUTLIER 74.22 155.4 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.532 -0.981 . . . . 0.0 109.723 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -170.44 155.93 5.32 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -105.64 137.12 44.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.362 -0.836 . . . . 0.0 108.788 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -94.26 136.04 34.99 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.149 -0.97 . . . . 0.0 109.722 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 39.8 p30 -68.77 -20.69 64.36 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.478 -0.764 . . . . 0.0 109.552 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.528 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 30.4 t70 -59.29 -49.41 77.96 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.076 -1.015 . . . . 0.0 109.234 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.4 pt -105.71 -4.07 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.453 -0.78 . . . . 0.0 109.571 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 49.0 49.05 20.05 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.69 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -145.6 165.99 27.05 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.299 -0.876 . . . . 0.0 109.593 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -88.54 127.19 35.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.54 -0.725 . . . . 0.0 109.462 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.93 153.31 49.64 Favored Pre-proline 0 N--CA 1.492 1.66 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -43.45 130.97 6.99 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 121.537 1.491 . . . . 0.0 112.096 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -150.99 113.92 4.75 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' O ' HG22 ' A' ' 43' ' ' THR . . . -141.0 163.57 32.61 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.35 -0.844 . . . . 0.0 109.668 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.0 mt -106.26 131.42 53.51 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -115.94 132.26 65.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.618 -0.677 . . . . 0.0 109.89 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -126.02 136.96 53.57 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -96.81 124.38 40.77 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 74.1 t -65.87 -42.17 91.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.484 -0.76 . . . . 0.0 109.79 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.98 -49.52 6.25 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -178.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.48 ' O ' ' O ' ' A' ' 36' ' ' PRO . 7.4 m -97.32 152.27 38.15 Favored Pre-proline 0 N--CA 1.5 2.051 0 O-C-N 120.946 -1.326 . . . . 0.0 109.638 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' VAL . 81.0 Cg_exo -47.38 -164.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.5 1.874 0 C-N-CA 122.608 2.205 . . . . 0.0 113.434 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -80.77 98.46 7.79 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.391 -0.818 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -105.13 157.36 17.31 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.474 -0.766 . . . . 0.0 109.096 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 29.1 m -44.84 133.84 5.02 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.803 . . . . 0.0 109.409 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.02 148.3 44.76 Favored 'Trans proline' 0 C--N 1.314 -1.245 0 C-N-CA 121.391 1.394 . . . . 0.0 111.296 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.4 mm -114.02 132.82 22.5 Favored Pre-proline 0 N--CA 1.498 1.935 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -74.4 150.21 40.95 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 121.752 1.635 . . . . 0.0 112.491 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -128.07 131.63 49.07 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.476 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.0 p -136.55 164.86 27.19 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.632 -0.668 . . . . 0.0 109.422 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 47' ' ' GLU . 77.7 t80 -138.12 121.63 11.39 Favored Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -43.15 82.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.196 1.931 . . . . 0.0 113.288 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 45' ' ' TYR . 47.3 tp10 -168.56 151.57 5.37 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.02 148.56 30.59 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.091 -1.005 . . . . 0.0 111.574 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.47 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 66.7 m-85 -157.05 104.76 2.1 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 25.6 p-10 -74.72 -6.39 48.53 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.177 -0.952 . . . . 0.0 110.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 84.3 mt -102.74 130.32 49.66 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.053 -1.03 . . . . 0.0 110.23 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -66.35 -40.25 89.69 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.472 -0.768 . . . . 0.0 109.279 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -50.88 71.0 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.049 -1.032 . . . . 0.0 109.47 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.47 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.7 t0 -65.47 -39.2 91.7 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.12 -0.988 . . . . 0.0 109.232 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.59 98.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.818 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.31 -43.81 85.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.05 -1.031 . . . . 0.0 109.315 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpp85 -62.53 -46.66 87.39 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.274 -0.891 . . . . 0.0 109.192 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.4 HG23 ' OD1' ' A' ' 54' ' ' ASP . 71.1 t -66.8 -42.62 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.565 -0.71 . . . . 0.0 109.781 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -56.01 -41.48 74.98 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.112 -0.993 . . . . 0.0 109.696 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.97 -44.66 97.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 O-C-N 121.134 -0.979 . . . . 0.0 109.238 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.9 -41.58 82.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.37 -39.79 85.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.302 -0.874 . . . . 0.0 109.786 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.94 -44.84 82.92 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.342 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.87 -42.1 97.6 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.144 -0.973 . . . . 0.0 109.737 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.1 mt -64.06 -43.56 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.175 -0.953 . . . . 0.0 109.629 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' A' ' 66' ' ' ILE . 30.1 mm -63.29 -43.14 98.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.295 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.87 -44.82 99.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 121.173 -0.955 . . . . 0.0 109.4 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -65.78 -45.91 80.69 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.122 -0.986 . . . . 0.0 109.15 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.5 m -62.19 -39.02 91.33 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.428 -0.795 . . . . 0.0 109.75 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.406 ' CE1' ' N ' ' A' ' 79' ' ' ALA . 86.4 t60 -58.93 -50.16 75.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.121 -0.987 . . . . 0.0 110.219 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.52 -43.23 94.69 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.086 -1.009 . . . . 0.0 109.329 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -66.42 -42.63 87.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.224 -0.922 . . . . 0.0 110.12 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.48 ' O ' ' CB ' ' A' ' 74' ' ' HIS . 33.9 ptt-85 -161.77 -155.11 0.37 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 0.0 109.923 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.48 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 11.8 t-80 81.35 136.3 0.06 Allowed 'General case' 0 N--CA 1.498 1.963 0 CA-C-O 121.231 0.538 . . . . 0.0 109.79 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -86.5 -76.27 0.36 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.443 -0.786 . . . . 0.0 109.521 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.33 -109.31 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.286 -0.884 . . . . 0.0 109.16 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.32 -126.44 40.05 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 mt -94.32 31.79 1.66 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.382 -1.069 . . . . 0.0 109.496 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.406 ' N ' ' CE1' ' A' ' 70' ' ' HIS . . . -61.57 -36.2 79.95 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 0.0 109.748 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.87 -38.15 87.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.119 -0.988 . . . . 0.0 109.401 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.1 mt -83.23 -2.95 56.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.155 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 117.989 -1.451 . . . . 0.0 109.549 179.994 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.2 mtp . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 58.79 34.51 23.77 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 19.5 m -89.96 154.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.92 0.867 . . . . 0.0 110.755 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.06 134.19 55.06 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.855 0.836 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -81.97 146.91 29.5 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.701 0.763 . . . . 0.0 110.373 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.64 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 15.8 t80 -154.32 113.95 3.78 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.582 0.706 . . . . 0.0 109.423 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.64 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 46.57 36.1 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.684 0.754 . . . . 0.0 110.184 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.11 -20.08 38.78 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 6' ' ' TYR . 93.4 m-85 -86.76 137.37 32.49 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.379 -1.071 . . . . 0.0 110.122 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -91.99 149.23 21.65 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.466 0.65 . . . . 0.0 109.312 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 90.7 mt -122.82 132.26 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 CA-C-O 121.724 0.773 . . . . 0.0 109.435 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -120.62 88.49 43.35 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.87 147.37 81.77 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.66 2.24 . . . . 0.0 112.375 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.59 -173.72 35.22 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.507 ' CD2' ' OE2' ' A' ' 52' ' ' GLU . 53.7 p-80 -141.08 122.53 15.0 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.759 0.79 . . . . 0.0 109.964 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -154.6 155.33 34.53 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.907 0.86 . . . . 0.0 110.129 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -110.53 145.94 36.88 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.683 0.754 . . . . 0.0 110.071 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.733 ' HE ' HG21 ' A' ' 44' ' ' THR . 95.0 mtt-85 -101.32 137.67 39.35 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.703 0.763 . . . . 0.0 109.756 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -68.46 -15.27 63.49 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.717 -0.614 . . . . 0.0 109.95 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -62.83 -43.26 99.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.375 -0.828 . . . . 0.0 109.362 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.8 pt -114.96 -7.92 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.1 mmm180 55.17 44.11 28.31 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.433 0.635 . . . . 0.0 110.09 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -141.3 161.08 38.74 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.616 0.722 . . . . 0.0 110.49 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.96 128.67 34.73 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.947 0.879 . . . . 0.0 109.85 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.7 m -140.19 149.18 57.27 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -37.04 108.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.315 -1.196 0 C-N-CA 122.939 2.426 . . . . 0.0 112.387 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -104.78 119.89 40.07 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.669 0.747 . . . . 0.0 109.957 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.485 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -144.86 147.64 33.04 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.835 0.826 . . . . 0.0 109.577 179.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.8 mt -109.62 133.83 52.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.621 0.724 . . . . 0.0 109.199 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 mm -103.18 123.05 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.453 HH22 ' C ' ' A' ' 36' ' ' PRO . 20.8 mmm180 -127.94 137.31 52.22 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.9 0.857 . . . . 0.0 110.22 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -101.89 141.56 34.56 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.899 0.857 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.8 t -60.78 132.73 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-O 121.952 0.882 . . . . 0.0 110.637 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 80.15 20.36 67.53 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.401 ' O ' ' O ' ' A' ' 36' ' ' PRO . 23.0 t -133.06 82.38 54.64 Favored Pre-proline 0 N--CA 1.502 2.145 0 O-C-N 121.308 -1.113 . . . . 0.0 109.665 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.453 ' C ' HH22 ' A' ' 31' ' ' ARG . 51.5 Cg_exo -53.07 -160.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.707 2.272 . . . . 0.0 112.468 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -52.45 110.84 0.54 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.611 0.72 . . . . 0.0 110.108 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 mmm180 -137.99 62.28 1.57 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 121.563 0.697 . . . . 0.0 109.426 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 m 50.64 79.66 0.33 Allowed Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -57.92 145.34 91.56 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.487 2.125 . . . . 0.0 112.515 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.543 ' N ' HD12 ' A' ' 41' ' ' ILE . 0.9 OUTLIER -127.32 89.26 51.99 Favored Pre-proline 0 N--CA 1.493 1.676 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.788 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.39 143.05 56.08 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.702 2.268 . . . . 0.0 112.833 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.485 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 14.8 t -105.32 134.83 47.77 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.821 0.819 . . . . 0.0 109.831 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.733 HG21 ' HE ' ' A' ' 18' ' ' ARG . 47.0 p -141.2 167.26 22.61 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.54 0.686 . . . . 0.0 109.871 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.578 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.5 OUTLIER -128.44 146.49 60.07 Favored Pre-proline 0 N--CA 1.486 1.367 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -48.99 -37.18 36.71 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 122.058 1.839 . . . . 0.0 111.271 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -45.55 150.55 0.48 Allowed 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.798 0.808 . . . . 0.0 110.15 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -121.85 139.6 53.42 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.822 0.82 . . . . 0.0 110.045 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.417 ' CE2' HG21 ' A' ' 58' ' ' VAL . 67.7 m-85 -141.66 111.93 6.92 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.686 0.755 . . . . 0.0 109.341 179.136 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.49 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 20.1 p-10 -68.32 -33.08 73.66 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.76 136.68 39.02 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.014 0.911 . . . . 0.0 109.942 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.507 ' OE2' ' CD2' ' A' ' 15' ' ' HIS . 43.6 tt0 -70.71 -37.07 73.52 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.765 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.71 -39.19 93.28 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.556 -0.715 . . . . 0.0 110.326 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -65.16 -38.97 92.25 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.45 -0.781 . . . . 0.0 109.362 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.91 89.19 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.614 -0.679 . . . . 0.0 109.819 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -66.85 -47.64 71.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.472 -0.768 . . . . 0.0 109.768 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -66.17 -44.1 85.03 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 121.47 0.652 . . . . 0.0 109.865 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.417 HG21 ' CE2' ' A' ' 49' ' ' TYR . 75.5 t -66.98 -41.28 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 109.575 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.0 p -57.87 -39.47 77.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.573 -0.704 . . . . 0.0 109.715 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.0 -45.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.62 -39.18 77.34 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.497 0.665 . . . . 0.0 109.764 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.578 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 5.9 t -70.92 -37.36 72.9 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.478 -0.764 . . . . 0.0 109.662 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.86 87.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.69 -0.631 . . . . 0.0 109.711 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -64.02 -42.93 96.96 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.563 0.697 . . . . 0.0 109.293 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.3 mt -65.36 -43.51 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.647 -0.658 . . . . 0.0 109.642 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -64.22 -44.18 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 110.104 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.2 mt -65.1 -43.68 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.642 -0.661 . . . . 0.0 109.306 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -66.24 -43.65 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.628 -0.67 . . . . 0.0 109.456 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.0 p -68.27 -36.66 79.74 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.56 0.695 . . . . 0.0 109.435 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.453 ' ND1' ' OD1' ' A' ' 75' ' ' ASP . 84.3 t60 -61.27 -45.29 95.1 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.628 -0.67 . . . . 0.0 109.76 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 81.3 mt -64.65 -42.91 95.09 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.468 0.651 . . . . 0.0 109.639 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -75.55 -17.87 59.94 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -151.38 106.6 3.31 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -72.97 105.67 4.55 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.852 0.834 . . . . 0.0 109.551 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.453 ' OD1' ' ND1' ' A' ' 70' ' ' HIS . 39.6 p-10 -96.94 9.0 43.22 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.567 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 67.26 8.57 6.32 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.816 0.817 . . . . 0.0 109.256 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.68 -37.83 89.43 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.98 25.96 10.72 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.716 -0.873 . . . . 0.0 109.64 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.12 79.55 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.353 -0.842 . . . . 0.0 109.426 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.466 ' HB2' HD11 ' A' ' 41' ' ' ILE . 99.7 m-20 -62.5 -40.81 97.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.445 0.64 . . . . 0.0 109.64 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -84.84 -2.56 57.91 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -179.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.7 mtm . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -82.11 144.68 30.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.6 m -108.63 131.02 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-O 121.839 0.828 . . . . 0.0 110.108 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.44 155.34 17.92 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.546 -0.721 . . . . 0.0 109.509 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -109.52 141.39 42.05 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.71 0.767 . . . . 0.0 109.947 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -153.69 122.59 6.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.41 -0.806 . . . . 0.0 109.21 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 54.83 25.91 7.17 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.634 0.73 . . . . 0.0 110.083 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.48 8.37 77.55 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -110.84 142.94 42.18 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.349 -1.089 . . . . 0.0 110.292 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -91.91 142.34 27.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.407 -0.808 . . . . 0.0 109.438 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.13 130.62 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.511 -0.743 . . . . 0.0 109.591 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -120.83 94.22 48.87 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -78.26 148.6 24.2 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.608 2.205 . . . . 0.0 113.101 -178.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.78 115.04 0.39 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -55.18 136.91 48.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -1.038 . . . . 0.0 111.034 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -153.59 149.29 27.46 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.467 -0.771 . . . . 0.0 109.32 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -106.78 134.32 50.11 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.858 0.837 . . . . 0.0 110.119 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 94.2 mtt180 -94.13 138.19 32.47 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.538 -0.726 . . . . 0.0 109.786 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -68.66 -20.74 64.47 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.531 -0.731 . . . . 0.0 109.434 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.83 -43.68 95.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.904 . . . . 0.0 109.784 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 15.1 pt -112.12 -0.31 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' ARG . 90.2 mtm-85 43.28 37.2 1.22 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.64 -0.662 . . . . 0.0 110.401 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -137.48 162.56 33.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.253 -0.905 . . . . 0.0 110.172 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -86.12 128.57 34.9 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.843 0.83 . . . . 0.0 109.85 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.5 m -145.84 147.63 33.16 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -37.27 110.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.707 2.272 . . . . 0.0 112.17 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -119.58 118.42 30.96 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.38 -0.825 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.1 155.0 44.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.312 -0.868 . . . . 0.0 109.179 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -111.08 130.28 55.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.731 . . . . 0.0 109.254 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 98.1 mt -107.11 130.65 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -134.81 138.51 44.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.501 -0.75 . . . . 0.0 109.048 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.53 137.48 32.3 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -0.812 . . . . 0.0 110.196 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 76.7 t -70.11 133.61 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.692 0.758 . . . . 0.0 110.39 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.34 -30.12 10.72 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.534 HG23 ' NH2' ' A' ' 38' ' ' ARG . 2.3 m -148.59 52.12 1.13 Allowed Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.157 -1.202 . . . . 0.0 109.638 179.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 72.9 Cg_endo -76.29 -10.74 19.21 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.509 2.139 . . . . 0.0 110.591 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 51.9 p-10 -91.03 54.85 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.46 -0.775 . . . . 0.0 109.689 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.58 ' NH2' ' O ' ' A' ' 81' ' ' LEU . 70.0 mtm180 -119.27 -107.24 0.37 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.447 -0.783 . . . . 0.0 110.023 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.6 m -135.09 86.91 30.38 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.495 -0.753 . . . . 0.0 109.052 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -55.19 140.46 81.08 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.763 2.309 . . . . 0.0 112.035 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.88 131.05 24.04 Favored Pre-proline 0 N--CA 1.495 1.777 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.81 142.78 44.11 Favored 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.132 1.888 . . . . 0.0 112.494 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.8 t -119.22 130.22 55.36 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.642 0.734 . . . . 0.0 109.089 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -139.22 167.45 22.05 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.553 ' O ' ' N ' ' A' ' 47' ' ' GLU . 82.6 t80 -120.62 123.8 27.89 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.596 -0.69 . . . . 0.0 109.193 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -43.35 80.54 0.01 OUTLIER 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 122.576 2.184 . . . . 0.0 112.561 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 45' ' ' TYR . 81.2 tt0 -172.69 157.76 3.88 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.266 -0.896 . . . . 0.0 109.028 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -112.09 140.08 47.07 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.361 -0.837 . . . . 0.0 109.486 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.475 ' CZ ' ' OE2' ' A' ' 47' ' ' GLU . 37.7 m-85 -135.7 131.56 35.79 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.38 -0.825 . . . . 0.0 108.9 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -93.32 -23.95 18.3 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.83 137.76 32.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.068 -1.02 . . . . 0.0 110.181 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -71.13 -37.51 72.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.48 -0.762 . . . . 0.0 109.398 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.49 84.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 109.421 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.7 -41.46 98.12 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.405 -0.81 . . . . 0.0 109.506 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.2 96.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 109.981 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.85 -44.25 70.24 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.118 -0.989 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -67.68 -43.01 81.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.162 -0.961 . . . . 0.0 110.027 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.92 -42.68 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.709 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -60.35 -42.15 95.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.623 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 93.7 mt -65.52 -44.47 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.147 -0.971 . . . . 0.0 109.691 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.71 -39.3 80.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.053 -1.03 . . . . 0.0 109.211 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.8 t -69.54 -38.37 77.48 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.406 -0.809 . . . . 0.0 109.625 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.9 -46.13 85.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.48 -43.82 96.21 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.118 -0.989 . . . . 0.0 109.455 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.57 -43.06 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.908 . . . . 0.0 109.394 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.44 -44.05 98.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.177 -0.952 . . . . 0.0 109.586 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.02 -44.48 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.216 -0.928 . . . . 0.0 109.447 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -66.4 -41.98 88.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.431 -0.793 . . . . 0.0 109.878 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.8 p -67.63 -35.73 79.47 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.237 -0.914 . . . . 0.0 109.692 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.476 ' CD2' ' H ' ' A' ' 78' ' ' LEU . 54.4 t-80 -60.64 -43.86 97.08 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.334 -0.854 . . . . 0.0 109.61 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.87 -41.78 97.69 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.863 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -83.48 -77.22 0.26 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.17 -0.956 . . . . 0.0 110.24 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 74' ' ' HIS . 53.4 ttp180 -109.38 -123.78 0.26 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.342 -0.849 . . . . 0.0 109.945 -179.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.415 ' C ' ' O ' ' A' ' 73' ' ' ARG . 15.1 m80 36.69 87.26 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.025 0.917 . . . . 0.0 110.341 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 76' ' ' GLN . 55.3 t0 -71.79 147.82 46.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.432 -0.792 . . . . 0.0 109.818 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.443 ' O ' ' O ' ' A' ' 75' ' ' ASP . 99.4 mm-40 57.5 148.86 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.842 0.829 . . . . 0.0 110.774 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.56 -77.53 0.32 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.476 ' H ' ' CD2' ' A' ' 70' ' ' HIS . 25.1 mt -108.36 24.85 12.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.466 -1.02 . . . . 0.0 109.476 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.86 89.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -64.58 -35.63 81.62 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.306 -0.871 . . . . 0.0 109.485 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.58 ' O ' ' NH2' ' A' ' 38' ' ' ARG . 85.1 mt -83.27 14.74 3.33 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.217 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -74.32 146.78 42.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.417 -0.802 . . . . 0.0 110.362 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.6 m -75.25 135.76 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.436 -0.79 . . . . 0.0 109.907 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.8 157.35 16.18 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -0.842 . . . . 0.0 109.978 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.22 143.43 41.99 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.67 -0.644 . . . . 0.0 109.528 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -155.47 126.3 6.99 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.435 -0.791 . . . . 0.0 109.448 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.427 HH21 HD13 ' A' ' 71' ' ' LEU . 22.1 mmm180 53.22 24.75 3.88 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.705 0.764 . . . . 0.0 109.615 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 33' ' ' VAL . . . 89.63 -16.67 55.89 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -84.9 143.17 29.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -1.102 . . . . 0.0 110.49 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -90.12 143.94 26.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.468 -0.77 . . . . 0.0 109.063 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.5 mt -124.3 129.9 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.611 -0.68 . . . . 0.0 109.275 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.497 ' O ' ' HB1' ' A' ' 28' ' ' ALA . 31.7 mt-10 -115.5 126.34 27.85 Favored Pre-proline 0 N--CA 1.492 1.663 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.93 158.45 38.54 Favored 'Trans proline' 0 N--CA 1.495 1.588 0 C-N-CA 122.351 2.034 . . . . 0.0 113.098 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.3 -176.6 45.26 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -147.79 124.53 11.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.347 -1.09 . . . . 0.0 109.015 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -146.12 157.46 43.84 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.924 . . . . 0.0 109.06 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -106.5 145.9 31.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.624 -0.672 . . . . 0.0 110.175 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.422 HH21 ' CD1' ' A' ' 21' ' ' ILE . 88.9 mtm180 -92.87 140.03 29.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.459 -0.776 . . . . 0.0 110.117 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -67.44 -28.46 67.91 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.396 -0.815 . . . . 0.0 109.534 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -60.26 -49.02 79.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.463 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.422 ' CD1' HH21 ' A' ' 18' ' ' ARG . 18.7 pt -106.29 0.03 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.493 -0.755 . . . . 0.0 109.502 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 43.19 44.71 4.55 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.413 -0.805 . . . . 0.0 109.833 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -137.92 161.41 36.72 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.397 -0.814 . . . . 0.0 110.081 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -84.32 133.41 34.54 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.572 0.701 . . . . 0.0 110.171 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.6 155.25 41.77 Favored Pre-proline 0 N--CA 1.487 1.395 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -42.42 120.47 1.68 Allowed 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 122.167 1.911 . . . . 0.0 111.9 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -126.18 127.98 46.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.704 -0.623 . . . . 0.0 109.747 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -150.99 157.69 43.19 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.307 -0.871 . . . . 0.0 109.2 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 86.0 mt -106.63 135.34 48.32 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -117.35 132.03 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.82 -0.55 . . . . 0.0 109.809 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -131.84 138.6 48.55 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.5 0.667 . . . . 0.0 109.403 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -83.48 135.97 34.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.513 -0.742 . . . . 0.0 110.058 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 8' ' ' GLY . 91.3 t -81.57 131.91 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.421 -0.8 . . . . 0.0 110.045 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 132.93 -66.65 0.57 Allowed Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.46 ' O ' ' O ' ' A' ' 36' ' ' PRO . 19.2 m -98.45 151.68 37.58 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.41 -1.053 . . . . 0.0 110.391 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' VAL . 89.0 Cg_exo -47.42 -166.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 122.805 2.337 . . . . 0.0 113.577 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -81.78 106.63 13.87 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.46 -0.775 . . . . 0.0 109.881 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.462 ' O ' ' O ' ' A' ' 39' ' ' THR . 25.2 mmt85 -107.23 83.05 1.76 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.621 0.724 . . . . 0.0 109.157 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 38' ' ' ARG . 9.8 m 47.3 102.2 0.03 OUTLIER Pre-proline 0 N--CA 1.488 1.434 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.108 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.05 146.05 28.63 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 121.957 1.771 . . . . 0.0 112.52 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.413 HD11 ' OD2' ' A' ' 80' ' ' ASP . 31.7 mm -115.07 93.74 36.11 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.25 140.64 51.54 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.13 1.887 . . . . 0.0 112.068 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 t -99.03 136.14 39.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.422 -0.799 . . . . 0.0 109.631 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -132.47 161.06 34.69 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.541 ' O ' ' O ' ' A' ' 46' ' ' PRO . 4.4 t80 -142.03 140.62 19.87 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 45' ' ' TYR . 76.7 Cg_exo -46.24 -131.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.974 2.449 . . . . 0.0 113.39 178.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' PRO . 58.8 mp0 44.29 -170.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.097 -1.002 . . . . 0.0 110.468 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 49' ' ' TYR . 71.2 m-85 -145.7 149.3 34.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.145 -0.972 . . . . 0.0 109.8 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.413 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 64.1 m-85 -146.9 105.94 3.87 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.475 -0.766 . . . . 0.0 109.133 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -72.65 -17.59 61.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.4 mt -96.53 126.73 41.92 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.81 0.814 . . . . 0.0 109.92 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -69.37 -38.06 77.87 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.457 0.646 . . . . 0.0 109.811 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -46.63 87.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.369 -0.832 . . . . 0.0 109.745 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -65.2 -36.03 82.9 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.486 -0.759 . . . . 0.0 109.475 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.33 -38.74 92.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.315 -0.866 . . . . 0.0 109.433 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.77 -48.07 78.41 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.883 . . . . 0.0 109.594 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -46.1 89.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 109.289 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.8 t -64.0 -42.69 96.5 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.729 -0.607 . . . . 0.0 109.524 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.477 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 45.6 m -55.25 -39.94 70.36 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.079 -1.013 . . . . 0.0 109.566 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.499 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.2 mt -64.03 -44.99 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 120.96 -1.088 . . . . 0.0 109.098 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.92 79.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.9 . . . . 0.0 109.737 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.5 m -66.75 -38.29 86.32 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.286 -0.884 . . . . 0.0 109.172 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.8 -43.57 77.0 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.405 -0.809 . . . . 0.0 109.212 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.499 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 33.5 mtmm -62.84 -42.17 99.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.105 -0.997 . . . . 0.0 109.532 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.07 -43.44 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.43 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.63 -43.57 98.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.297 -0.877 . . . . 0.0 109.591 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.23 -45.15 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.035 -1.04 . . . . 0.0 109.557 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.83 -41.69 97.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.472 ' O ' ' N ' ' A' ' 73' ' ' ARG . 5.5 t -65.95 -37.91 87.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.289 -0.882 . . . . 0.0 109.425 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.65 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 81.7 t60 -56.39 -45.12 80.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.217 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.427 HD13 HH21 ' A' ' 7' ' ' ARG . 64.9 mt -65.13 -38.48 90.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.363 -0.836 . . . . 0.0 109.543 179.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -85.89 -73.28 0.46 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.884 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.499 ' O ' ' CB ' ' A' ' 74' ' ' HIS . 33.0 ptt180 -126.59 -140.08 0.27 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.623 -0.673 . . . . 0.0 109.688 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.499 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 13.6 t60 84.78 139.63 0.06 Allowed 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.64 0.733 . . . . 0.0 110.126 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.412 ' O ' ' C ' ' A' ' 76' ' ' GLN . 99.4 m-20 -83.94 111.5 19.31 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.401 -0.812 . . . . 0.0 109.968 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 75' ' ' ASP . 57.8 tt0 36.97 85.21 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.556 0.693 . . . . 0.0 110.933 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.29 -85.5 1.64 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.65 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 42.8 mt -111.01 31.77 5.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.48 -1.011 . . . . 0.0 109.462 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.44 -36.67 84.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.902 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.42 ' OD2' ' O ' ' A' ' 39' ' ' THR . 21.3 p-10 -59.6 -45.84 90.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 109.893 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.52 -41.45 96.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 0.0 110.197 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 CA-C-O 117.87 -1.517 . . . . 0.0 109.574 -179.642 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.8 ttm . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -82.16 142.23 32.39 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.757 0.789 . . . . 0.0 109.991 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.2 m -82.33 134.27 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.849 0.833 . . . . 0.0 109.967 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.43 160.33 14.85 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.67 0.747 . . . . 0.0 110.094 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -108.0 147.17 31.47 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.778 0.799 . . . . 0.0 109.812 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -151.71 119.11 5.99 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.864 0.84 . . . . 0.0 110.051 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.434 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.7 mtp180 45.85 32.09 1.21 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.441 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.22 -23.03 35.33 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -84.03 141.47 31.15 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.516 -0.99 . . . . 0.0 110.317 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -94.3 140.08 30.25 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.742 0.782 . . . . 0.0 109.697 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -116.75 128.89 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.678 0.752 . . . . 0.0 109.719 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -123.97 96.49 42.46 Favored Pre-proline 0 N--CA 1.492 1.645 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.13 154.7 37.47 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 122.874 2.383 . . . . 0.0 112.689 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.8 95.75 0.11 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -47.43 146.74 1.93 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.791 -0.829 . . . . 0.0 109.919 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -146.98 157.99 43.79 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.872 0.844 . . . . 0.0 109.799 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -101.34 119.94 39.52 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.733 0.777 . . . . 0.0 109.615 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -95.78 137.86 34.25 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.828 0.823 . . . . 0.0 110.001 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.94 -24.3 41.12 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -62.6 -44.81 95.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.59 -0.693 . . . . 0.0 109.626 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.3 pt -106.98 1.27 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.46 -0.775 . . . . 0.0 109.279 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 42.95 39.59 1.83 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.594 0.711 . . . . 0.0 109.689 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HG3' ' H ' ' A' ' 24' ' ' TYR . 29.4 tptt -145.88 161.46 39.96 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.774 0.797 . . . . 0.0 110.21 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.402 ' H ' ' HG3' ' A' ' 23' ' ' LYS . 95.7 m-85 -85.96 132.7 34.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.916 0.865 . . . . 0.0 109.449 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.6 m -148.1 148.44 29.55 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.796 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.47 110.42 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.745 2.296 . . . . 0.0 111.868 178.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.8 121.44 40.8 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.812 0.815 . . . . 0.0 109.837 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.53 ' O ' HG22 ' A' ' 43' ' ' THR . . . -143.03 154.11 43.65 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.692 0.758 . . . . 0.0 109.995 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.4 mt -111.4 129.43 56.02 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.695 0.759 . . . . 0.0 109.321 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -108.81 130.22 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.712 0.768 . . . . 0.0 109.813 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -130.57 130.83 44.56 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.847 0.832 . . . . 0.0 109.704 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -84.76 135.87 33.94 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.841 0.829 . . . . 0.0 109.837 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 73.1 t -66.89 133.54 31.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.754 0.788 . . . . 0.0 110.124 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.422 ' O ' HG13 ' A' ' 35' ' ' VAL . . . 105.34 -17.63 43.32 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.422 HG13 ' O ' ' A' ' 34' ' ' GLY . 16.9 m -154.86 56.74 1.51 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.721 -0.87 . . . . 0.0 109.199 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.51 -12.39 31.38 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 122.598 2.199 . . . . 0.0 111.033 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.497 ' CG ' ' H ' ' A' ' 38' ' ' ARG . 65.1 t0 -71.83 -124.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.752 -0.592 . . . . 0.0 109.897 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.497 ' H ' ' CG ' ' A' ' 37' ' ' ASP . 18.6 mmm180 44.28 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.661 0.743 . . . . 0.0 110.576 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.9 m -92.03 129.89 40.16 Favored Pre-proline 0 N--CA 1.484 1.255 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 147.32 34.2 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.367 2.045 . . . . 0.0 112.531 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -114.23 126.49 27.93 Favored Pre-proline 0 N--CA 1.487 1.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -74.99 145.54 31.62 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 C-N-CA 122.427 2.085 . . . . 0.0 112.333 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER -122.87 130.73 53.23 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.866 0.841 . . . . 0.0 109.575 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.9 p -141.07 167.42 22.24 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.713 0.768 . . . . 0.0 109.568 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.504 ' O ' ' N ' ' A' ' 47' ' ' GLU . 55.3 t80 -123.88 126.84 25.59 Favored Pre-proline 0 N--CA 1.488 1.448 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -46.28 83.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 122.446 2.097 . . . . 0.0 112.251 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 45' ' ' TYR . 45.2 tp10 -170.79 147.6 2.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 109.374 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -109.88 127.52 54.77 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.607 0.718 . . . . 0.0 109.686 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.05 133.5 54.32 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.979 0.895 . . . . 0.0 109.778 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -87.09 -24.31 24.61 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -103.72 132.53 49.89 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.974 0.892 . . . . 0.0 109.732 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.654 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 1.1 pm0 -68.83 -34.86 76.19 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.39 -47.68 72.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.667 -0.646 . . . . 0.0 109.323 -179.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.412 ' O ' HG23 ' A' ' 58' ' ' VAL . 54.4 m-20 -65.21 -37.58 87.73 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.575 -0.703 . . . . 0.0 109.371 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -36.45 82.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.735 -0.603 . . . . 0.0 109.566 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.61 -51.42 67.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.708 -0.62 . . . . 0.0 109.616 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -63.66 -43.47 96.63 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.393 0.616 . . . . 0.0 109.53 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 54' ' ' ASP . 72.5 t -64.96 -39.61 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.3 m -55.89 -43.14 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.578 -0.701 . . . . 0.0 109.519 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.18 -45.88 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.602 -0.686 . . . . 0.0 109.593 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.87 -36.82 80.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.545 -0.722 . . . . 0.0 109.293 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -65.8 -49.44 68.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.647 -0.658 . . . . 0.0 109.732 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.44 -39.77 64.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.736 -0.602 . . . . 0.0 109.661 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -39.82 94.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.71 -0.619 . . . . 0.0 109.688 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.68 -43.97 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.67 -0.644 . . . . 0.0 109.855 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.36 -43.54 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.528 -0.732 . . . . 0.0 109.462 -179.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.2 mt -63.7 -44.71 98.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.434 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 97.2 m-20 -69.99 -44.77 68.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.429 0.633 . . . . 0.0 109.77 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' ARG . 15.1 t -65.7 -42.02 91.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.666 -0.646 . . . . 0.0 109.781 -179.32 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -59.24 -44.75 92.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.641 -0.662 . . . . 0.0 109.468 -179.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.2 -43.08 96.15 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.645 -0.66 . . . . 0.0 110.025 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -87.3 -71.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.497 -0.752 . . . . 0.0 109.062 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 69' ' ' SER . 89.0 mtm180 -78.59 147.21 33.79 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.71 0.767 . . . . 0.0 110.043 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -55.49 -87.72 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.477 ' O ' ' N ' ' A' ' 77' ' ' GLY . 58.9 t0 44.02 70.52 0.31 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.442 0.639 . . . . 0.0 109.514 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -43.66 95.27 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.72 0.771 . . . . 0.0 109.817 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 75' ' ' ASP . . . -118.75 -60.75 0.28 Allowed Glycine 0 N--CA 1.494 2.521 0 N-CA-C 108.934 -1.667 . . . . 0.0 108.934 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.5 mt -100.35 21.34 13.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.581 -0.952 . . . . 0.0 108.456 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.34 98.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.931 -0.48 . . . . 0.0 109.944 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.86 -35.83 81.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.682 -0.636 . . . . 0.0 109.547 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.2 mt -85.1 -6.26 59.31 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 109.5 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.675 0 CA-C-O 117.952 -1.471 . . . . 0.0 109.729 -179.774 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.4 ttp . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -73.96 140.33 45.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.51 -0.743 . . . . 0.0 109.777 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.4 m -87.8 155.18 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.447 -0.783 . . . . 0.0 109.754 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.86 133.28 53.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.563 -0.711 . . . . 0.0 109.525 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -83.34 135.17 34.82 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.413 -0.804 . . . . 0.0 109.971 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -144.0 117.86 9.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.347 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.449 ' HE ' ' CD1' ' A' ' 71' ' ' LEU . 78.5 mtp85 53.85 29.15 9.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.551 -0.718 . . . . 0.0 109.758 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.09 -4.56 83.04 Favored Glycine 0 N--CA 1.494 2.531 0 N-CA-C 110.199 -1.161 . . . . 0.0 110.199 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -105.89 134.44 49.02 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.456 -1.026 . . . . 0.0 109.935 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.89 144.6 25.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 109.091 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 78.8 mt -120.19 136.45 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.249 0.547 . . . . 0.0 109.628 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -121.56 85.61 43.71 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -61.48 150.22 86.17 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.858 2.372 . . . . 0.0 112.536 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.566 ' O ' ' CG ' ' A' ' 15' ' ' HIS . . . -174.01 -9.1 0.02 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.566 ' CG ' ' O ' ' A' ' 14' ' ' GLY . 3.9 p-80 56.57 153.34 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.785 -0.832 . . . . 0.0 110.571 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -169.24 153.11 5.23 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.494 -0.754 . . . . 0.0 109.059 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -98.99 137.49 37.45 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.537 -0.727 . . . . 0.0 109.649 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -92.19 135.95 33.58 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.582 -0.699 . . . . 0.0 109.593 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.47 -19.95 63.75 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.51 -0.744 . . . . 0.0 109.504 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -62.95 -44.65 95.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.477 -0.765 . . . . 0.0 109.88 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.2 pt -109.71 2.76 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.666 -0.646 . . . . 0.0 109.289 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 43.44 43.05 4.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.626 -0.672 . . . . 0.0 109.438 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.8 tptm -139.39 164.46 29.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.409 -0.807 . . . . 0.0 109.732 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -85.1 129.97 34.7 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.734 -0.604 . . . . 0.0 109.765 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' H ' ' A' ' 48' ' ' PHE . 0.5 OUTLIER -150.17 155.17 37.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.378 -0.826 . . . . 0.0 108.998 179.512 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -43.47 135.83 6.41 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.198 1.932 . . . . 0.0 112.693 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE2' ' CB ' ' A' ' 42' ' ' PRO . 48.7 t80 -153.5 114.47 4.1 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.39 152.35 49.55 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.388 -0.82 . . . . 0.0 109.706 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.05 129.62 44.89 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.4 mt -115.83 131.41 68.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.627 -0.671 . . . . 0.0 110.035 -179.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -132.9 145.74 51.19 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.586 -0.696 . . . . 0.0 109.21 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -82.62 128.23 34.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.211 -0.93 . . . . 0.0 109.797 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.4 t -74.54 133.8 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.566 -0.709 . . . . 0.0 110.165 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 115.42 -51.42 0.72 Allowed Glycine 0 N--CA 1.494 2.548 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 36' ' ' PRO . 9.1 m -99.83 151.79 37.6 Favored Pre-proline 0 N--CA 1.497 1.904 0 O-C-N 121.311 -1.111 . . . . 0.0 110.138 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.448 ' O ' ' O ' ' A' ' 35' ' ' VAL . 74.9 Cg_exo -47.36 -170.99 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.715 2.277 . . . . 0.0 113.031 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 37' ' ' ASP . 45.1 p-10 -98.25 108.13 20.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.579 -0.701 . . . . 0.0 109.649 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.567 HH21 ' C ' ' A' ' 81' ' ' LEU . 96.4 mtm-85 -98.44 -173.5 2.57 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.248 -0.908 . . . . 0.0 110.25 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.541 ' O ' HD21 ' A' ' 81' ' ' LEU . 45.9 m -40.15 105.77 0.38 Allowed Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.918 -0.489 . . . . 0.0 109.825 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -75.45 146.86 31.58 Favored 'Trans proline' 0 N--CA 1.493 1.499 0 C-N-CA 122.197 1.932 . . . . 0.0 113.024 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.407 HD12 ' O ' ' A' ' 39' ' ' THR . 4.5 mp -134.35 90.69 24.21 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.479 ' CB ' ' CE2' ' A' ' 27' ' ' TYR . 48.3 Cg_exo -54.72 144.75 63.7 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.319 2.013 . . . . 0.0 111.87 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 t -99.67 136.14 40.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.581 -0.699 . . . . 0.0 109.227 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -136.56 157.52 46.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -139.31 101.35 7.54 Favored Pre-proline 0 N--CA 1.492 1.64 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.2 107.14 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 121.825 1.683 . . . . 0.0 112.475 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 48' ' ' PHE . 54.6 mt-10 -150.66 -13.13 0.24 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.482 ' H ' HG12 ' A' ' 25' ' ' VAL . 1.6 m-85 54.24 108.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.238 0.542 . . . . 0.0 110.1 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -131.54 132.86 44.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.582 -0.699 . . . . 0.0 109.417 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -87.24 -22.11 25.41 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.736 . . . . 0.0 109.316 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -91.12 133.08 35.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.466 -0.771 . . . . 0.0 110.659 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -67.62 -38.02 83.33 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.55 -40.45 91.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 109.759 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 58' ' ' VAL . 99.5 m-20 -62.75 -43.3 99.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.433 -0.792 . . . . 0.0 109.817 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.48 96.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.453 -0.78 . . . . 0.0 110.034 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -66.91 -49.44 65.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.401 -0.812 . . . . 0.0 109.911 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -65.99 -43.65 87.18 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.514 -0.741 . . . . 0.0 109.653 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 54' ' ' ASP . 67.6 t -65.11 -42.65 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.603 -0.686 . . . . 0.0 109.532 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -58.09 -42.23 85.18 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.458 -0.777 . . . . 0.0 109.87 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.421 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.4 mt -64.81 -44.85 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.139 -0.975 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.06 -44.36 80.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.502 -0.749 . . . . 0.0 109.485 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.1 m -65.86 -43.62 87.83 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.583 -0.698 . . . . 0.0 109.265 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -50.17 -42.91 51.96 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.421 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 64.2 mttp -63.31 -43.01 99.03 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.489 -0.757 . . . . 0.0 109.302 179.445 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.12 -44.75 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.375 -0.828 . . . . 0.0 109.774 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -66.04 -45.93 89.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.376 -0.828 . . . . 0.0 109.138 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.8 mt -64.75 -44.65 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.485 -0.759 . . . . 0.0 109.629 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -68.52 -46.35 69.8 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.538 -0.727 . . . . 0.0 109.87 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.6 m -62.63 -42.15 99.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.568 -0.708 . . . . 0.0 110.094 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.402 ' O ' ' O ' ' A' ' 73' ' ' ARG . 76.3 t60 -59.16 -42.34 90.51 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.754 . . . . 0.0 109.674 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.449 ' CD1' ' HE ' ' A' ' 7' ' ' ARG . 81.9 mt -64.88 -36.0 82.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.588 -0.695 . . . . 0.0 109.719 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -64.93 -16.59 63.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.854 . . . . 0.0 109.626 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.402 ' O ' ' O ' ' A' ' 70' ' ' HIS . 17.3 ptm180 -151.44 -145.21 0.17 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.275 -0.891 . . . . 0.0 109.223 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 19.0 p80 -141.07 43.77 1.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -0.873 . . . . 0.0 108.908 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.527 ' O ' ' N ' ' A' ' 77' ' ' GLY . 53.5 t0 -63.3 123.52 18.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.414 -0.804 . . . . 0.0 109.157 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -42.68 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.62 -0.675 . . . . 0.0 109.841 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 75' ' ' ASP . . . -152.96 -83.01 0.04 OUTLIER Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.6 mt -101.91 17.87 22.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.536 -0.979 . . . . 0.0 109.521 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.93 -38.68 89.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.393 -0.817 . . . . 0.0 109.48 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.85 -37.28 86.79 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.524 -0.735 . . . . 0.0 109.835 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.567 ' C ' HH21 ' A' ' 38' ' ' ARG . 54.2 mt -83.38 -3.14 57.24 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.354 -0.841 . . . . 0.0 109.121 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.317 0.579 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.76 140.62 32.68 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.267 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -83.19 149.85 26.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.0 110.267 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.406 ' N ' ' O ' ' A' ' 9' ' ' TYR . 88.1 t80 -153.54 115.04 4.2 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.409 -0.807 . . . . 0.0 109.327 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.488 HH12 ' CD1' ' A' ' 71' ' ' LEU . 20.7 mtp-105 52.07 30.18 7.22 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 109.921 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.68 -1.87 81.82 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.406 ' O ' ' N ' ' A' ' 6' ' ' TYR . 95.4 m-85 -106.73 141.93 37.19 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.373 -1.075 . . . . 0.0 109.761 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -89.72 146.1 24.74 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.524 -0.735 . . . . 0.0 109.491 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -121.59 136.52 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' ' H ' ' A' ' 29' ' ' LEU . 21.7 tt0 -119.18 87.68 35.46 Favored Pre-proline 0 N--CA 1.496 1.857 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.11 146.05 95.68 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.524 2.149 . . . . 0.0 112.204 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.54 -167.72 39.37 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -148.48 142.9 26.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.283 -1.127 . . . . 0.0 109.535 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -161.85 150.57 15.48 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -109.09 143.5 38.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.476 -0.765 . . . . 0.0 109.66 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.438 ' NH2' HG21 ' A' ' 44' ' ' THR . 86.2 mtt180 -99.47 139.11 35.61 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 121.529 0.68 . . . . 0.0 109.83 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.26 -20.24 64.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.442 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.92 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.154 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.5 pt -109.63 0.02 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 42.12 39.64 1.44 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.785 -0.572 . . . . 0.0 109.868 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -140.5 161.45 37.7 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.285 -0.885 . . . . 0.0 109.825 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -85.73 130.86 34.45 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.429 0.633 . . . . 0.0 109.854 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.98 146.85 32.58 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.45 -0.781 . . . . 0.0 109.338 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -37.72 111.55 0.1 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 122.571 2.181 . . . . 0.0 112.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -121.57 117.33 26.5 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -142.15 159.0 43.11 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.193 -0.942 . . . . 0.0 109.592 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.431 ' H ' ' HB3' ' A' ' 12' ' ' GLU . 53.8 mt -113.6 134.47 54.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.638 -0.664 . . . . 0.0 109.238 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.9 mt -111.92 133.1 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.681 -0.637 . . . . 0.0 109.53 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -127.32 130.63 49.84 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -83.4 138.64 33.41 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.646 0.736 . . . . 0.0 110.326 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.5 t . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.718 -0.614 . . . . 0.0 109.939 -179.777 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.25 151.92 44.11 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.887 1.725 . . . . 0.0 111.882 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.489 HD11 ' OD2' ' A' ' 80' ' ' ASP . 38.6 mm -115.48 100.21 53.33 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.57 136.2 41.13 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 121.897 1.731 . . . . 0.0 112.483 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 p -95.27 134.97 37.45 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.438 HG21 ' NH2' ' A' ' 18' ' ' ARG . 54.7 p -138.01 167.16 22.36 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -148.89 141.68 15.42 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.178 -0.951 . . . . 0.0 108.929 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.56 86.33 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.88 1.72 . . . . 0.0 112.226 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -176.4 169.5 2.66 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.499 -0.751 . . . . 0.0 108.98 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -130.7 146.91 52.3 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.418 -0.801 . . . . 0.0 109.413 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.505 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 27.9 m-85 -141.81 123.46 15.1 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.356 -0.84 . . . . 0.0 109.589 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.16 -33.25 67.57 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.355 0.598 . . . . 0.0 109.701 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -89.45 133.12 34.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.805 . . . . 0.0 110.538 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -69.57 -36.04 75.91 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.452 0.644 . . . . 0.0 109.476 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.58 91.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.506 -0.746 . . . . 0.0 109.515 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.505 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 58.0 t0 -63.09 -38.01 89.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.378 -0.826 . . . . 0.0 109.051 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.41 -36.64 84.81 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.493 -0.754 . . . . 0.0 109.639 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.53 -49.48 75.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 109.731 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.63 -42.77 95.27 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.272 -0.892 . . . . 0.0 109.444 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.5 t -65.22 -42.78 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.564 -0.71 . . . . 0.0 109.631 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 98.1 p -56.62 -39.39 73.55 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.411 -0.805 . . . . 0.0 109.676 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.84 -45.29 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 109.296 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.71 82.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.339 -0.851 . . . . 0.0 109.423 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.56 -46.15 76.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.468 -0.77 . . . . 0.0 109.5 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.13 73.99 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.369 -0.832 . . . . 0.0 109.452 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.42 -43.96 95.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.301 -0.874 . . . . 0.0 109.365 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.37 -44.38 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.433 -0.792 . . . . 0.0 110.104 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 32.7 mm -64.17 -44.38 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.157 -0.964 . . . . 0.0 109.404 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 94.7 mt -64.38 -45.66 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.159 -0.963 . . . . 0.0 109.506 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.28 -46.36 77.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.338 -0.852 . . . . 0.0 109.635 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.2 m -63.15 -37.91 89.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.546 -0.721 . . . . 0.0 109.85 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -59.78 -47.9 83.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.631 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.488 ' CD1' HH12 ' A' ' 7' ' ' ARG . 90.6 mt -64.18 -42.8 96.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.348 -0.845 . . . . 0.0 109.871 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 . . . . . 0 N--CA 1.493 1.721 0 O-C-N 121.319 -0.863 . . . . 0.0 110.33 -179.493 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.18 30.55 1.23 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.275 -1.133 . . . . 0.0 109.305 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.15 -35.81 81.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.648 -0.658 . . . . 0.0 109.308 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.489 ' OD2' HD11 ' A' ' 41' ' ' ILE . 23.1 p-10 -64.69 -31.88 73.3 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.481 -0.762 . . . . 0.0 109.625 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.35 -3.29 57.36 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.326 -0.859 . . . . 0.0 109.471 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.68 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.173 0.511 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.28 140.82 47.67 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.575 -0.703 . . . . 0.0 109.433 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.9 m170 -85.13 154.13 22.23 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.401 -0.812 . . . . 0.0 110.307 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.615 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 20.6 t80 -153.3 111.43 3.62 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.328 -0.857 . . . . 0.0 109.044 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.615 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 47.41 31.86 2.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.539 -0.726 . . . . 0.0 110.102 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.34 -20.74 47.98 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -85.4 138.42 32.27 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -1.067 . . . . 0.0 110.107 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.31 139.13 31.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.626 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.0 mt -121.29 130.42 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -121.93 87.94 47.31 Favored Pre-proline 0 N--CA 1.496 1.837 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -57.82 144.97 92.56 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 122.697 2.264 . . . . 0.0 112.506 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.91 98.19 0.11 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -49.01 155.82 0.58 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.434 -1.039 . . . . 0.0 110.793 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -154.87 157.87 38.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.39 -0.819 . . . . 0.0 109.051 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -99.96 120.66 40.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.593 -0.692 . . . . 0.0 109.396 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.483 ' NH1' ' OG1' ' A' ' 44' ' ' THR . 84.4 mtp180 -102.04 138.58 38.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.601 -0.687 . . . . 0.0 109.964 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.22 -17.03 58.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.554 -0.716 . . . . 0.0 109.404 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -59.64 -49.54 77.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.222 -0.924 . . . . 0.0 109.652 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.444 HG13 ' H ' ' A' ' 23' ' ' LYS . 41.1 pt -107.9 0.27 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 50.33 34.93 9.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.643 -0.661 . . . . 0.0 109.582 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.444 ' H ' HG13 ' A' ' 21' ' ' ILE . 56.0 mmtt -140.44 174.42 10.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.366 -0.834 . . . . 0.0 110.217 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -93.72 130.29 39.74 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.534 0.683 . . . . 0.0 109.954 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' O ' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -143.17 155.63 61.68 Favored Pre-proline 0 N--CA 1.492 1.632 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -55.37 110.19 0.52 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.211 1.941 . . . . 0.0 111.85 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -114.68 117.54 31.12 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -132.52 147.94 52.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.581 -0.699 . . . . 0.0 109.534 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -93.3 128.33 39.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.539 -0.726 . . . . 0.0 109.474 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.3 mt -110.01 127.5 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -132.0 133.27 44.26 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.582 -0.699 . . . . 0.0 109.395 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.42 125.6 40.15 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.661 0.744 . . . . 0.0 109.562 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.7 t . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.533 0.682 . . . . 0.0 110.694 -179.338 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.34 153.95 70.11 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.006 1.804 . . . . 0.0 112.272 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.6 mm -122.34 88.87 49.07 Favored Pre-proline 0 N--CA 1.494 1.732 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -55.25 146.6 59.81 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.662 2.241 . . . . 0.0 112.539 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.78 135.79 40.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.569 -0.707 . . . . 0.0 109.587 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.483 ' OG1' ' NH1' ' A' ' 18' ' ' ARG . 32.0 p -136.21 167.93 20.36 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -136.2 136.62 22.94 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.99 86.82 1.06 Allowed 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 121.974 1.783 . . . . 0.0 112.119 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.472 ' O ' ' CG1' ' A' ' 25' ' ' VAL . 8.9 tt0 -168.54 -173.35 1.9 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 109.213 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -133.69 121.17 21.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.609 -0.682 . . . . 0.0 109.26 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.508 ' C ' ' H ' ' A' ' 51' ' ' LEU . 91.8 m-85 -111.79 -36.88 5.31 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.9 t0 58.87 -0.3 0.14 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.775 -0.578 . . . . 0.0 109.925 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.8 mt -118.03 126.67 52.75 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.397 -0.815 . . . . 0.0 109.638 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.95 -42.49 80.85 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.591 -0.693 . . . . 0.0 109.641 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.66 -47.93 83.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.621 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 58' ' ' VAL . 38.7 t0 -67.0 -38.76 86.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.75 -40.98 98.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.304 -0.873 . . . . 0.0 109.216 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.87 -44.99 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.874 . . . . 0.0 109.649 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -65.63 -44.57 86.05 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.282 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 54' ' ' ASP . 72.0 t -67.87 -41.4 84.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.572 -0.705 . . . . 0.0 109.418 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.4 p -56.63 -41.32 76.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.207 -0.933 . . . . 0.0 109.616 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.34 -45.0 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.055 -1.028 . . . . 0.0 109.509 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.69 -46.04 73.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.375 -0.828 . . . . 0.0 109.96 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.5 m -66.24 -49.58 66.72 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.423 -0.798 . . . . 0.0 109.495 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -45.4 -46.14 13.1 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.679 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.59 -41.87 98.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.02 -43.93 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.152 -0.968 . . . . 0.0 109.466 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.64 -44.81 96.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -0.928 . . . . 0.0 108.621 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.07 -43.94 97.62 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 O-C-N 121.06 -1.025 . . . . 0.0 108.795 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.93 -41.82 97.53 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.317 -0.864 . . . . 0.0 109.19 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -60.91 -40.91 94.89 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.525 -0.734 . . . . 0.0 109.35 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -58.92 -44.84 91.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.194 -0.941 . . . . 0.0 109.157 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.14 -41.12 97.31 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.494 -0.754 . . . . 0.0 109.045 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 . . . . . 0 C--N 1.304 -1.406 0 O-C-N 121.405 -0.809 . . . . 0.0 109.432 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.61 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -85.26 33.05 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -1.151 . . . . 0.0 108.414 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.624 -0.672 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.9 -45.57 91.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.366 -0.834 . . . . 0.0 109.618 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.54 -41.39 93.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.337 -0.852 . . . . 0.0 109.773 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.021 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 -179.486 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 121.181 0.515 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.61 138.84 51.12 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.72 -0.612 . . . . 0.0 109.594 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -99.6 114.81 28.07 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.393 -0.817 . . . . 0.0 109.531 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -86.72 -75.62 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.432 -0.792 . . . . 0.0 109.66 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -127.2 52.14 1.83 Allowed 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 93.96 -0.41 66.92 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -112.39 140.32 47.22 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.385 -1.068 . . . . 0.0 109.993 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -84.21 145.13 28.51 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -120.94 130.2 74.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -127.3 97.75 30.88 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.93 153.79 37.73 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.422 2.082 . . . . 0.0 113.201 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.71 -150.14 8.09 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.52 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 52.7 p-80 -152.67 147.53 26.22 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -1.111 . . . . 0.0 109.428 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.427 ' OE1' ' CZ ' ' A' ' 27' ' ' TYR . 58.4 tt0 -169.05 157.67 8.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.392 -0.818 . . . . 0.0 109.02 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -110.04 145.77 36.47 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.464 0.65 . . . . 0.0 110.002 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.559 HH21 ' CG2' ' A' ' 44' ' ' THR . 35.2 mmt180 -96.32 125.24 40.69 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.658 0.742 . . . . 0.0 109.728 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 38.5 p-10 -70.22 -21.5 63.01 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.715 -0.615 . . . . 0.0 109.959 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -62.33 -42.58 99.49 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.764 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.6 pt -116.7 -6.8 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' ARG . 28.0 mmt180 55.82 57.55 5.11 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.4 0.619 . . . . 0.0 110.034 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -144.09 160.17 41.36 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 0.0 109.788 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -90.23 129.28 36.5 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.628 -0.67 . . . . 0.0 109.375 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 11.8 m -141.93 148.97 51.15 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.447 -0.783 . . . . 0.0 109.544 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -41.48 110.1 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.294 0 C-N-CA 122.307 2.004 . . . . 0.0 111.536 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.427 ' CZ ' ' OE1' ' A' ' 16' ' ' GLN . 56.2 t80 -103.66 116.74 32.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.804 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -139.77 144.29 37.35 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.1 mt -109.96 130.45 55.53 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.8 mt -112.71 131.04 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -129.04 132.3 47.46 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -83.89 138.78 33.01 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.427 -0.796 . . . . 0.0 109.619 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.7 t . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.407 -0.808 . . . . 0.0 110.36 -179.44 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.484 1.226 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.28 140.75 45.28 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.141 1.894 . . . . 0.0 112.582 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.93 103.27 54.85 Favored Pre-proline 0 N--CA 1.494 1.735 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.18 145.1 38.51 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.095 1.863 . . . . 0.0 112.061 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.804 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -108.64 137.49 46.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.548 -0.72 . . . . 0.0 109.457 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.559 ' CG2' HH21 ' A' ' 18' ' ' ARG . 45.8 p -138.09 167.85 20.95 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -130.99 140.39 38.53 Favored Pre-proline 0 N--CA 1.491 1.589 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -43.33 -28.25 1.49 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 122.207 1.938 . . . . 0.0 112.089 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.51 158.79 26.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.317 -0.864 . . . . 0.0 110.158 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -126.8 147.75 49.99 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.637 -0.665 . . . . 0.0 109.389 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.516 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 78.9 m-85 -152.44 114.52 4.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.326 -0.859 . . . . 0.0 109.801 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -71.13 -33.49 70.15 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.529 -0.732 . . . . 0.0 109.207 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -69.74 135.34 49.65 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.528 -0.733 . . . . 0.0 110.332 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.52 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 85.1 tt0 -71.74 -41.05 68.96 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.503 -0.748 . . . . 0.0 109.731 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.21 -45.94 86.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -0.874 . . . . 0.0 109.738 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.516 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.0 t0 -63.99 -38.58 91.6 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.346 -0.846 . . . . 0.0 109.546 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.64 91.83 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.47 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.81 -46.39 82.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.345 -0.847 . . . . 0.0 109.724 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -64.21 -44.38 92.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.325 -0.859 . . . . 0.0 109.621 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.3 t -67.32 -42.03 87.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.393 -0.817 . . . . 0.0 109.761 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.558 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 78.5 p -56.49 -40.75 75.47 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.688 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.441 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 96.6 mt -64.13 -45.66 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.983 -1.073 . . . . 0.0 109.155 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.09 -38.8 86.34 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.6 t -64.95 -50.55 65.98 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.537 -0.727 . . . . 0.0 109.437 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.66 -41.71 43.44 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.62 -0.675 . . . . 0.0 109.634 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.441 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 63.2 mttp -62.9 -41.35 99.41 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.293 -0.879 . . . . 0.0 109.337 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.5 mt -64.1 -43.84 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.839 . . . . 0.0 109.805 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 66' ' ' ILE . 2.0 mp -65.54 -45.33 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.0 109.129 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.62 -44.84 96.71 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.163 -0.961 . . . . 0.0 109.371 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -67.59 -43.78 79.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.333 -0.854 . . . . 0.0 109.719 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.402 ' HG ' ' HA ' ' A' ' 66' ' ' ILE . 78.0 p -67.04 -35.59 80.21 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.385 -0.822 . . . . 0.0 109.067 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.38 -43.99 92.81 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.285 -0.884 . . . . 0.0 109.394 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.9 mt -63.75 -40.99 98.06 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.377 -0.827 . . . . 0.0 109.218 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.438 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 57.3 t0 . . . . . 0 C--N 1.303 -1.454 0 O-C-N 121.351 -0.843 . . . . 0.0 109.198 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.409 ' C ' ' O ' ' A' ' 77' ' ' GLY . 9.1 mt 41.68 22.99 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.52 -0.988 . . . . 0.0 109.586 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' A' ' 77' ' ' GLY . . . -60.21 -47.71 84.81 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.55 -0.719 . . . . 0.0 109.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -65.68 -36.54 83.93 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.339 -0.85 . . . . 0.0 109.451 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.9 mt -84.09 -3.19 57.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.388 -0.82 . . . . 0.0 109.255 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 179.984 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.439 0.637 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -89.36 159.99 17.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.453 -0.779 . . . . 0.0 109.815 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.91 139.88 47.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.553 -0.717 . . . . 0.0 109.392 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -151.05 119.98 6.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.189 -0.945 . . . . 0.0 109.496 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 54.28 28.04 8.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.648 -0.658 . . . . 0.0 110.199 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 0.21 86.34 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -104.35 139.99 38.53 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.578 -0.954 . . . . 0.0 109.504 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.2 140.74 29.16 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.406 -0.809 . . . . 0.0 109.144 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -119.83 130.13 74.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -117.11 121.04 32.96 Favored Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.02 157.68 46.6 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.059 1.839 . . . . 0.0 112.565 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.05 -172.27 44.3 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -150.7 146.06 26.21 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.339 -1.095 . . . . 0.0 109.073 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.51 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 53.8 tt0 -168.47 155.62 7.66 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.276 -0.89 . . . . 0.0 109.002 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -104.91 139.9 38.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.494 -0.754 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.2 mtp180 -90.97 134.43 34.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.559 -0.713 . . . . 0.0 109.566 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 39.0 p-10 -68.29 -21.49 64.78 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.368 -0.833 . . . . 0.0 109.247 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -60.9 -47.68 85.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.554 -0.716 . . . . 0.0 109.867 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 18.6 pt -107.39 -2.5 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.473 -0.767 . . . . 0.0 108.99 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 49.21 46.64 22.77 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.504 -0.747 . . . . 0.0 110.051 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.25 165.9 26.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -0.821 . . . . 0.0 109.598 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -85.04 132.78 34.28 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.541 -0.725 . . . . 0.0 109.766 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.77 156.03 41.26 Favored Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.285 -0.884 . . . . 0.0 108.794 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -43.85 128.94 7.26 Favored 'Trans proline' 0 C--N 1.314 -1.273 0 C-N-CA 122.11 1.873 . . . . 0.0 112.067 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.51 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 66.0 t80 -131.85 120.38 22.5 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 59' ' ' SER . . . -144.53 151.71 39.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.168 -0.958 . . . . 0.0 108.789 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.2 mt -106.11 129.93 54.1 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.6 mt -110.68 130.44 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.638 -0.664 . . . . 0.0 109.32 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -131.24 126.66 36.06 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -81.49 139.24 35.28 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.339 -0.851 . . . . 0.0 109.741 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 69.9 t . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 110.246 -179.546 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.487 1.382 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -73.01 152.58 51.63 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 122.339 2.026 . . . . 0.0 112.512 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.6 mm -129.0 89.3 49.1 Favored Pre-proline 0 N--CA 1.499 1.987 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -56.1 145.75 73.87 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.317 2.011 . . . . 0.0 111.547 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -117.1 135.4 53.77 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.556 0.693 . . . . 0.0 109.821 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.0 p -138.03 166.2 24.68 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -133.01 133.89 23.74 Favored Pre-proline 0 N--CA 1.495 1.798 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.82 85.14 1.36 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.957 1.772 . . . . 0.0 112.329 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.443 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 80.7 tt0 -138.62 -16.18 1.17 Allowed 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 47' ' ' GLU . 9.6 m-85 58.39 119.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.131 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.533 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 12.4 m-85 -131.37 133.97 45.82 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.736 0.779 . . . . 0.0 109.419 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -85.06 -24.76 27.99 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.706 -0.621 . . . . 0.0 109.456 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.4 mm? -96.91 126.17 41.87 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 122.079 0.943 . . . . 0.0 109.854 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -67.76 -33.36 74.68 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.53 -47.32 86.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.609 -0.682 . . . . 0.0 110.016 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 14.9 t70 -64.35 -34.39 78.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.513 -0.742 . . . . 0.0 109.342 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.2 -42.3 90.58 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.564 -0.71 . . . . 0.0 109.538 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -64.13 -49.3 72.72 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.449 -0.782 . . . . 0.0 109.845 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -63.59 -43.93 95.5 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.488 -0.758 . . . . 0.0 109.418 -179.516 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.3 t -64.17 -42.27 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.374 -0.829 . . . . 0.0 109.286 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.539 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 31.2 m -52.39 -42.95 64.44 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.272 -0.892 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.02 -44.77 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.279 -0.888 . . . . 0.0 109.265 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.89 71.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.438 -0.789 . . . . 0.0 109.698 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.93 -43.29 99.16 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.484 -0.76 . . . . 0.0 109.147 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.34 -42.44 41.74 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.403 -0.811 . . . . 0.0 109.285 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -62.58 -43.67 98.23 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.38 -0.825 . . . . 0.0 109.251 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -65.82 -45.19 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.502 -0.749 . . . . 0.0 109.791 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.3 -44.47 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 0.0 109.165 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.03 -45.02 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.134 -0.979 . . . . 0.0 109.112 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -65.13 -44.26 89.23 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.468 -0.77 . . . . 0.0 109.606 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 39.4 m -63.76 -36.64 84.55 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.583 -0.698 . . . . 0.0 109.641 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 13.6 t60 -57.8 -50.62 72.66 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.1 mt -66.5 -42.01 88.03 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.48 -0.762 . . . . 0.0 110.171 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.36 -0.838 . . . . 0.0 110.279 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.451 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.4 mt 55.1 20.44 3.31 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.491 -1.005 . . . . 0.0 109.388 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.92 89.17 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.416 -0.802 . . . . 0.0 109.677 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.01 -37.45 87.25 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.362 -0.836 . . . . 0.0 109.475 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 44.1 mt -82.48 -3.8 56.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.383 -0.823 . . . . 0.0 109.428 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.481 ' CG1' ' OE1' ' A' ' 12' ' ' GLU . 15.3 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.636 0.731 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.73 153.02 19.18 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.501 -0.749 . . . . 0.0 109.622 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -103.65 128.65 50.93 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.574 -0.704 . . . . 0.0 109.771 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -143.03 121.89 12.7 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.403 -0.811 . . . . 0.0 109.574 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 54.14 24.73 5.06 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.534 0.683 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.62 4.09 80.16 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -109.53 139.5 44.46 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.532 -0.981 . . . . 0.0 109.975 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -87.28 144.93 26.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.391 -0.818 . . . . 0.0 109.577 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -123.47 131.79 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.667 -0.645 . . . . 0.0 109.417 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.481 ' OE1' ' CG1' ' A' ' 3' ' ' VAL . 8.8 tp10 -116.0 117.63 39.19 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.19 155.0 32.96 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.187 1.925 . . . . 0.0 112.845 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.99 -163.76 36.2 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -151.27 146.46 26.06 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.026 -1.279 . . . . 0.0 109.346 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.48 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 49.2 tt0 -166.23 155.31 11.34 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.165 -0.959 . . . . 0.0 109.755 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -107.24 135.51 48.64 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.316 0.579 . . . . 0.0 109.849 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.491 ' O ' ' N ' ' A' ' 22' ' ' ARG . 79.9 mtp85 -96.08 137.97 34.38 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.83 0.824 . . . . 0.0 109.981 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -67.31 -21.98 65.65 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.524 0.678 . . . . 0.0 109.306 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.61 -44.52 96.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.449 -0.782 . . . . 0.0 109.906 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.1 pt -114.68 0.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.491 ' N ' ' O ' ' A' ' 18' ' ' ARG . 84.5 mtt85 43.56 41.08 3.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.546 -0.721 . . . . 0.0 110.235 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -136.69 159.83 40.65 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.414 -0.804 . . . . 0.0 109.793 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -87.18 119.23 27.2 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.453 0.644 . . . . 0.0 109.735 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.6 m -130.93 152.83 81.32 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -41.74 114.11 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.722 1.615 . . . . 0.0 111.282 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.48 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 64.7 t80 -111.47 121.32 44.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.595 -0.691 . . . . 0.0 109.644 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 59' ' ' SER . . . -143.56 154.98 44.15 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.326 -0.859 . . . . 0.0 108.985 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.0 mt -112.31 132.46 54.95 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -113.09 131.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.4 ttm-85 -132.67 136.69 46.61 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.605 -0.685 . . . . 0.0 109.689 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -80.19 134.29 36.12 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.689 0.757 . . . . 0.0 109.735 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t . . . . . 0 N--CA 1.488 1.468 0 O-C-N 121.479 -0.763 . . . . 0.0 110.501 -179.25 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.2 m . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.95 154.13 37.89 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.169 1.913 . . . . 0.0 112.682 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.497 ' N ' HD12 ' A' ' 41' ' ' ILE . 4.3 mp -121.99 130.12 24.86 Favored Pre-proline 0 N--CA 1.494 1.738 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.4 148.93 55.68 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.125 1.883 . . . . 0.0 112.488 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.542 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -119.98 129.99 54.55 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.68 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.3 p -140.05 167.41 22.2 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 47' ' ' GLU . 9.2 t80 -135.58 136.53 24.02 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.637 -0.664 . . . . 0.0 109.626 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -45.38 81.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.373 2.049 . . . . 0.0 112.183 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 45' ' ' TYR . 6.3 pt-20 178.08 133.8 0.07 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -116.61 163.17 16.5 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.725 0.774 . . . . 0.0 109.491 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.512 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 90.0 m-85 -145.15 -35.24 0.32 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.583 -0.698 . . . . 0.0 109.257 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 49' ' ' TYR . 5.4 t0 79.84 -18.12 0.53 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 51' ' ' LEU . 3.6 mm? -98.98 126.36 44.66 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 122.185 0.993 . . . . 0.0 110.153 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -32.25 73.7 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.548 ' HB1' HH12 ' A' ' 57' ' ' ARG . . . -61.88 -51.79 66.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.307 -0.871 . . . . 0.0 109.914 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.512 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 39.2 t0 -72.14 -36.76 69.45 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.711 0.767 . . . . 0.0 109.486 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.08 -47.37 85.49 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.424 -0.798 . . . . 0.0 109.922 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.42 -45.1 89.01 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.548 HH12 ' HB1' ' A' ' 53' ' ' ALA . 84.8 mtt85 -63.87 -45.09 91.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.127 -0.983 . . . . 0.0 109.924 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -67.56 -42.34 86.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.333 -0.854 . . . . 0.0 109.093 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.575 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 99.9 p -55.76 -40.61 72.84 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.446 -0.784 . . . . 0.0 109.668 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.1 mt -64.94 -45.01 96.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.95 -1.094 . . . . 0.0 109.646 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.44 -42.26 79.11 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.048 -1.033 . . . . 0.0 109.549 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 90.6 m -68.55 -39.16 81.19 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.459 -0.776 . . . . 0.0 109.476 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -46.79 71.34 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.238 -0.914 . . . . 0.0 109.064 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -63.17 -41.73 99.28 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.39 -42.79 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.823 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.2 mm -63.69 -43.24 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.04 -1.037 . . . . 0.0 109.191 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 91.8 mt -62.88 -47.71 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 120.993 -1.067 . . . . 0.0 109.377 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -66.14 -44.12 85.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.381 -0.824 . . . . 0.0 109.698 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.8 t -63.23 -41.43 99.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.487 -0.758 . . . . 0.0 109.315 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.504 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 73.5 t60 -58.77 -39.08 79.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.423 -0.798 . . . . 0.0 109.634 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.4 -42.54 98.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.223 -0.923 . . . . 0.0 110.112 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.234 -0.917 . . . . 0.0 110.192 -179.466 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.535 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.493 2.444 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.8 mt 63.04 -9.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 122.004 -0.704 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.535 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.9 -34.17 77.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.003 -1.06 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.466 ' HB2' HD11 ' A' ' 41' ' ' ILE . 99.2 m-20 -65.01 -13.95 59.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.428 -0.795 . . . . 0.0 109.474 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.99 -5.17 59.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.22 -0.925 . . . . 0.0 109.003 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.79 -1.561 . . . . 0.0 109.321 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.128 0.489 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.22 135.44 54.68 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.637 -0.664 . . . . 0.0 109.28 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m170 -84.6 146.7 27.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.429 -0.794 . . . . 0.0 110.373 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -154.6 119.16 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.527 -0.733 . . . . 0.0 109.117 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? 54.69 26.81 7.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.627 -0.67 . . . . 0.0 109.921 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.63 2.8 81.59 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -107.45 140.08 40.96 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.553 -0.969 . . . . 0.0 109.709 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -89.92 142.08 28.04 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.5 -0.75 . . . . 0.0 109.476 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -123.97 132.75 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -119.91 87.95 39.35 Favored Pre-proline 0 N--CA 1.496 1.835 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.66 149.4 68.12 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 122.734 2.289 . . . . 0.0 112.463 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.24 139.68 4.69 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 15' ' ' HIS . 45.2 p-80 -95.1 123.23 38.48 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.521 -0.988 . . . . 0.0 109.96 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -149.91 153.16 36.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.156 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -104.36 138.9 40.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.636 -0.665 . . . . 0.0 109.468 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -103.02 141.9 35.02 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.489 0.661 . . . . 0.0 110.349 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -68.77 -8.81 46.57 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.292 -0.88 . . . . 0.0 109.378 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -68.06 -52.86 30.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.49 ' CD1' ' H ' ' A' ' 23' ' ' LYS . 1.2 pp -108.26 7.27 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 40.89 37.92 0.59 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.823 -0.548 . . . . 0.0 110.123 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.49 ' H ' ' CD1' ' A' ' 21' ' ' ILE . 34.7 mmtt -141.16 176.79 8.55 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.352 -0.843 . . . . 0.0 109.706 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -86.82 127.43 35.01 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.303 0.573 . . . . 0.0 109.633 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -138.61 154.75 73.52 Favored Pre-proline 0 N--CA 1.493 1.681 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -58.52 110.29 0.63 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.239 1.959 . . . . 0.0 111.496 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -112.62 118.4 34.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.514 -0.741 . . . . 0.0 109.37 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 43' ' ' THR . . . -144.01 153.6 42.39 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -102.82 133.88 47.16 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.634 -0.666 . . . . 0.0 109.554 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.3 mt -110.0 128.07 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -136.41 138.86 41.98 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.628 -0.67 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -93.61 134.69 35.65 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.474 -0.766 . . . . 0.0 109.556 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.589 -0.694 . . . . 0.0 110.224 -179.554 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.1 m . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.54 143.49 55.87 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 122.35 2.034 . . . . 0.0 112.127 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.3 mp -124.03 125.04 25.89 Favored Pre-proline 0 N--CA 1.491 1.601 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -71.63 143.96 43.37 Favored 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 121.842 1.694 . . . . 0.0 112.278 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 28' ' ' ALA . 1.3 t -107.2 137.0 46.09 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -130.52 165.07 23.48 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.536 ' O ' ' N ' ' A' ' 47' ' ' GLU . 24.2 t80 -139.1 110.74 7.81 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -45.53 83.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.966 1.777 . . . . 0.0 112.33 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 45' ' ' TYR . 8.4 tm-20 -171.91 132.24 0.69 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.252 -0.905 . . . . 0.0 109.085 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -98.9 125.66 44.37 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 108.991 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.526 ' CE2' ' OE1' ' A' ' 47' ' ' GLU . 84.8 m-85 -109.03 -32.37 7.27 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.6 t0 62.97 -3.8 0.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.4 mt -115.47 131.54 56.9 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.595 -0.691 . . . . 0.0 109.737 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -68.47 -39.43 81.39 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.651 -0.656 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -50.34 74.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.74 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -64.34 -40.2 95.41 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.46 -0.775 . . . . 0.0 109.427 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.77 92.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.476 -0.765 . . . . 0.0 109.95 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -66.98 -49.37 65.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.403 -0.81 . . . . 0.0 110.1 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -64.98 -44.2 90.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.334 -0.854 . . . . 0.0 109.659 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.7 t -66.7 -42.37 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.56 -0.712 . . . . 0.0 109.564 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 p -54.72 -40.41 69.22 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.245 -0.909 . . . . 0.0 109.549 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -65.22 -45.02 95.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.204 -0.935 . . . . 0.0 109.368 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.34 51.83 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.404 -0.81 . . . . 0.0 109.733 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.1 m -60.92 -38.9 87.36 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.557 -0.715 . . . . 0.0 109.28 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.86 -41.12 70.42 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.46 -0.775 . . . . 0.0 109.188 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.18 -38.71 92.24 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.338 -0.852 . . . . 0.0 109.123 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.56 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.453 -0.779 . . . . 0.0 109.665 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.35 -44.35 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.339 -0.851 . . . . 0.0 108.746 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.68 -44.36 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.313 -0.867 . . . . 0.0 109.272 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.49 -41.51 96.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.563 -0.711 . . . . 0.0 109.573 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -61.58 -41.99 98.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.529 -0.732 . . . . 0.0 110.012 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -61.21 -47.16 87.4 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.125 -0.984 . . . . 0.0 109.467 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.87 -42.2 95.03 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.481 -0.762 . . . . 0.0 109.321 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 N--CA 1.487 1.401 0 O-C-N 121.553 -0.717 . . . . 0.0 109.653 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.689 -1.365 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.3 mt -112.16 32.68 5.35 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.959 . . . . 0.0 109.138 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.71 88.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.553 -0.717 . . . . 0.0 109.554 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.69 -34.77 79.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.595 -0.691 . . . . 0.0 109.899 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.2 mt -80.18 -2.93 46.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.617 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 CA-C-O 117.866 -1.519 . . . . 0.0 109.428 179.747 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.688 0.756 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.04 131.3 43.98 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.76 0.79 . . . . 0.0 109.706 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -83.86 149.26 26.49 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.671 0.748 . . . . 0.0 110.184 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -153.43 113.65 3.96 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.763 0.792 . . . . 0.0 109.401 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.8 mtp180 49.41 29.52 2.88 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.631 0.729 . . . . 0.0 110.104 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 96.23 -19.61 53.77 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -83.71 142.14 30.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -1.029 . . . . 0.0 110.625 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.49 145.81 24.53 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.624 -0.673 . . . . 0.0 109.604 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 94.6 mt -125.21 129.72 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-O 121.483 0.659 . . . . 0.0 109.483 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -123.68 93.23 47.73 Favored Pre-proline 0 N--CA 1.495 1.781 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.49 157.46 32.58 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.759 2.306 . . . . 0.0 113.209 -178.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.3 -133.71 1.75 Allowed Glycine 0 N--CA 1.488 2.153 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.545 ' ND1' ' OE2' ' A' ' 52' ' ' GLU . 20.2 p-80 -160.05 135.67 8.33 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.435 -1.038 . . . . 0.0 109.899 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.525 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 54.2 tt0 -166.62 154.4 9.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.639 -0.663 . . . . 0.0 109.301 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.9 p90 -112.79 144.62 42.01 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 121.711 0.767 . . . . 0.0 109.942 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.693 ' HE ' HG21 ' A' ' 44' ' ' THR . 94.6 mtt-85 -99.15 137.67 37.35 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.622 0.725 . . . . 0.0 109.969 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -68.21 -20.31 64.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.774 -0.579 . . . . 0.0 109.886 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -65.37 -42.43 92.75 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.314 -0.866 . . . . 0.0 109.917 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 11.4 pt -109.91 -6.16 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.47 -0.769 . . . . 0.0 109.016 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 48.25 44.13 19.45 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.807 0.813 . . . . 0.0 109.964 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -145.56 163.21 35.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.509 -0.745 . . . . 0.0 110.202 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -86.22 132.12 34.08 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.843 0.83 . . . . 0.0 110.229 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.8 m -142.49 148.72 48.22 Favored Pre-proline 0 N--CA 1.491 1.592 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -39.94 109.99 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.395 2.063 . . . . 0.0 111.416 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.525 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 56.1 t80 -104.08 120.29 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.603 0.716 . . . . 0.0 109.961 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.617 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -142.13 145.8 34.65 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.496 -0.753 . . . . 0.0 109.097 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.41 HD21 ' CE2' ' A' ' 27' ' ' TYR . 65.7 mt -110.14 126.57 54.2 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 91.0 mt -104.05 127.45 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.516 0.674 . . . . 0.0 109.532 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -130.1 137.98 50.45 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.59 0.71 . . . . 0.0 109.464 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -95.2 130.53 41.9 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 109.28 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.3 -179.252 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.71 144.14 98.2 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.348 2.032 . . . . 0.0 112.393 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.14 89.97 51.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -52.87 141.6 55.04 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 C-N-CA 122.517 2.145 . . . . 0.0 112.227 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.617 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 12.1 t -108.65 134.61 51.15 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.812 0.815 . . . . 0.0 110.003 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.693 HG21 ' HE ' ' A' ' 18' ' ' ARG . 56.9 p -139.66 166.85 23.5 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.608 ' O ' ' N ' ' A' ' 47' ' ' GLU . 8.8 t80 -136.05 133.42 19.7 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -42.78 76.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.898 2.399 . . . . 0.0 112.382 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.608 ' N ' ' O ' ' A' ' 45' ' ' TYR . 39.8 mt-10 -155.06 145.05 21.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.564 -0.71 . . . . 0.0 109.131 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -115.39 110.15 18.93 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.696 -0.628 . . . . 0.0 109.345 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.419 ' CE2' HG21 ' A' ' 58' ' ' VAL . 48.6 m-85 -124.28 129.79 51.37 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.557 0.694 . . . . 0.0 109.669 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -92.99 -24.84 18.23 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -78.68 143.02 36.67 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.826 0.822 . . . . 0.0 110.323 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.545 ' OE2' ' ND1' ' A' ' 15' ' ' HIS . 46.2 tp10 -71.89 -38.49 69.97 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.578 0.704 . . . . 0.0 109.758 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.97 87.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.79 . . . . 0.0 109.862 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 58' ' ' VAL . 34.9 m-20 -63.68 -43.43 96.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 109.739 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.12 88.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.512 -0.743 . . . . 0.0 109.899 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -69.37 -45.08 70.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.487 -0.758 . . . . 0.0 110.08 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -64.07 -45.4 88.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.335 -0.853 . . . . 0.0 110.037 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.419 HG21 ' CE2' ' A' ' 49' ' ' TYR . 75.7 t -67.53 -41.79 86.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.558 0.694 . . . . 0.0 109.742 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.52 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 88.1 p -57.18 -42.43 81.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.37 -0.831 . . . . 0.0 110.045 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.87 -45.07 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.117 -0.989 . . . . 0.0 109.645 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.89 -49.45 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.222 -0.924 . . . . 0.0 109.805 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.1 m -61.82 -35.19 77.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.473 -0.767 . . . . 0.0 109.485 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.55 -41.03 89.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.395 -0.815 . . . . 0.0 109.523 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.26 -45.74 86.78 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.296 -0.877 . . . . 0.0 109.805 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.404 ' N ' HD12 ' A' ' 65' ' ' ILE . 3.0 mp -67.47 -42.08 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.369 -0.832 . . . . 0.0 109.818 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -62.22 -43.74 98.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 121.384 -0.822 . . . . 0.0 109.789 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.95 -44.71 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.228 -0.92 . . . . 0.0 109.319 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.457 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 73.9 m-20 -64.24 -44.06 92.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.378 -0.826 . . . . 0.0 109.264 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.2 p -64.47 -47.6 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 0.0 109.768 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.705 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 53.8 t60 -47.06 -44.02 20.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.293 -0.879 . . . . 0.0 109.441 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.402 HD13 HH22 ' A' ' 7' ' ' ARG . 90.0 mt -63.34 -40.72 98.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.38 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 N--CA 1.497 1.894 0 O-C-N 121.453 -0.779 . . . . 0.0 109.266 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.705 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 59.5 mt -102.59 14.65 31.42 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.326 -1.102 . . . . 0.0 109.201 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.12 -26.08 68.38 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.505 -0.747 . . . . 0.0 109.9 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -68.08 -17.16 64.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.325 -0.859 . . . . 0.0 109.676 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.9 mt -92.93 -2.13 56.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.186 -0.947 . . . . 0.0 109.262 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.807 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.8 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.666 0.746 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.8 139.89 48.05 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -101.63 122.48 43.95 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.737 0.779 . . . . 0.0 109.876 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -101.69 -101.12 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.403 0.621 . . . . 0.0 109.509 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -90.96 51.46 1.96 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.361 -0.837 . . . . 0.0 109.546 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.7 90.51 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.06 138.19 44.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.506 -0.997 . . . . 0.0 109.896 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -80.45 141.07 35.6 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.629 -0.669 . . . . 0.0 109.379 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.6 mt -119.47 129.0 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.38 0.61 . . . . 0.0 109.448 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -132.22 97.97 17.58 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -76.94 154.11 33.3 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.622 2.215 . . . . 0.0 112.868 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.2 102.89 0.17 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -42.05 129.68 3.6 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.69 -0.888 . . . . 0.0 110.713 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.441 ' CD ' ' H ' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -156.93 158.1 36.02 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.614 0.721 . . . . 0.0 109.427 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.441 ' H ' ' CD ' ' A' ' 16' ' ' GLN . 48.3 p90 -113.5 145.8 40.63 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.817 0.817 . . . . 0.0 110.038 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.636 HH21 ' CG2' ' A' ' 44' ' ' THR . 32.3 mmt180 -92.51 130.75 38.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.767 0.794 . . . . 0.0 109.612 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 45.1 p-10 -71.72 -23.78 61.68 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.73 -0.606 . . . . 0.0 109.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 90.7 m-20 -61.79 -44.64 96.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.6 pt -109.39 -7.63 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.378 -0.826 . . . . 0.0 109.102 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 54.8 53.43 10.51 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.591 0.71 . . . . 0.0 110.197 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -146.53 162.36 38.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.383 -0.823 . . . . 0.0 110.377 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -88.14 128.53 35.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.617 -0.677 . . . . 0.0 109.664 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.8 m -147.14 148.24 31.45 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.484 -0.76 . . . . 0.0 109.391 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -42.47 109.23 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 122.282 1.988 . . . . 0.0 111.508 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.407 ' OH ' HD21 ' A' ' 29' ' ' LEU . 75.0 t80 -112.39 120.96 43.47 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.347 -0.846 . . . . 0.0 110.163 -179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.807 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -137.72 145.67 42.79 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.427 HD13 ' NH2' ' A' ' 31' ' ' ARG . 83.1 mt -101.78 130.26 48.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.537 -0.727 . . . . 0.0 109.301 -179.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 93.1 mt -109.64 124.4 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 CA-C-O 121.579 0.704 . . . . 0.0 109.901 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.427 ' NH2' HD13 ' A' ' 29' ' ' LEU . 3.9 mpt_? -130.61 140.44 50.42 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.644 0.735 . . . . 0.0 109.572 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -86.9 137.25 32.54 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-O 121.606 0.717 . . . . 0.0 109.643 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.806 0.812 . . . . 0.0 110.583 -179.459 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 N--CA 1.495 1.797 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.08 146.91 46.14 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.427 2.085 . . . . 0.0 112.721 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -109.75 111.02 59.19 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.55 157.42 44.67 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.546 2.164 . . . . 0.0 112.461 -179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.807 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 1.0 OUTLIER -121.97 135.55 54.86 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.577 0.703 . . . . 0.0 109.71 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.636 ' CG2' HH21 ' A' ' 18' ' ' ARG . 43.7 p -131.03 166.84 20.14 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' A' ' 47' ' ' GLU . 1.1 t80 -135.58 133.19 20.08 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.509 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 77.1 Cg_exo -45.23 -12.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.313 2.009 . . . . 0.0 111.468 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' TYR . 97.0 mt-10 -84.0 160.27 21.05 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.57 -0.706 . . . . 0.0 109.937 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -131.28 148.65 52.71 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.598 0.713 . . . . 0.0 109.362 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.527 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 62.4 m-85 -149.62 118.91 6.82 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.477 -0.765 . . . . 0.0 109.241 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -74.12 -13.39 60.82 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -94.67 128.54 41.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 109.877 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -67.79 -36.15 79.93 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.483 0.659 . . . . 0.0 110.19 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.36 -43.87 92.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.365 -0.834 . . . . 0.0 109.753 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 51.3 t0 -65.94 -38.85 89.7 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.417 -0.802 . . . . 0.0 109.544 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.95 -37.07 86.07 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.531 -0.731 . . . . 0.0 109.595 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -64.48 -50.24 68.23 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.392 -0.818 . . . . 0.0 109.807 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -67.27 -44.06 80.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.833 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 54' ' ' ASP . 74.4 t -67.4 -42.98 87.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.457 -0.777 . . . . 0.0 110.238 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.487 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 77.8 p -59.6 -41.08 89.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 110.206 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -65.83 -44.44 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 120.987 -1.07 . . . . 0.0 109.473 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -45.2 76.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.437 -0.789 . . . . 0.0 109.898 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.57 -46.38 72.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.361 -0.837 . . . . 0.0 109.985 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -48.2 -46.15 34.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.448 -0.783 . . . . 0.0 109.799 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.34 -41.82 98.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.361 -0.837 . . . . 0.0 109.418 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 91.0 mt -64.47 -44.03 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.505 -0.747 . . . . 0.0 109.691 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.15 -43.99 99.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.01 -44.03 99.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 O-C-N 121.583 -0.698 . . . . 0.0 109.2 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.23 -42.62 93.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.668 0.747 . . . . 0.0 109.301 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.7 t -69.92 -34.12 73.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.554 -0.716 . . . . 0.0 109.789 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.498 ' ND1' HD12 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -57.75 -47.74 81.62 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.282 -0.886 . . . . 0.0 108.78 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.5 mt -64.25 -40.32 95.77 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.9 t0 . . . . . 0 C--N 1.298 -1.672 0 CA-C-O 121.508 0.67 . . . . 0.0 109.711 179.599 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.916 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.498 HD12 ' ND1' ' A' ' 70' ' ' HIS . 46.5 mt -109.84 32.96 4.67 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.514 -0.992 . . . . 0.0 108.854 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.42 76.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.519 -0.738 . . . . 0.0 109.315 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.92 -37.44 87.4 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.424 -0.797 . . . . 0.0 109.261 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.5 mt -86.8 -5.69 59.04 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.096 -1.002 . . . . 0.0 108.805 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.92 -1.489 . . . . 0.0 109.413 179.507 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 121.813 0.816 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.29 146.77 31.1 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -102.83 136.9 41.8 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.741 0.781 . . . . 0.0 110.217 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -149.38 120.69 7.85 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.77 0.795 . . . . 0.0 109.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 48.98 30.84 2.96 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.741 0.781 . . . . 0.0 110.452 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.32 -20.26 41.85 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -81.02 144.16 31.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.341 -1.093 . . . . 0.0 110.299 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -104.32 139.07 39.83 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -115.01 137.57 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.648 0.737 . . . . 0.0 110.122 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -118.65 90.0 38.74 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.62 145.85 46.33 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.947 2.431 . . . . 0.0 112.907 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.28 -171.95 40.53 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -149.15 141.02 23.68 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.999 . . . . 0.0 109.773 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -170.02 155.74 5.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.587 -0.696 . . . . 0.0 109.514 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -105.3 137.9 42.36 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.861 0.838 . . . . 0.0 110.146 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.4 141.16 36.44 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.389 0.614 . . . . 0.0 109.585 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 37.4 p-10 -68.44 -8.28 39.3 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.756 0.789 . . . . 0.0 109.349 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -64.27 -42.44 96.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.392 -0.818 . . . . 0.0 109.205 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.412 ' O ' ' C ' ' A' ' 22' ' ' ARG . 1.1 pp -122.58 12.71 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ILE . 89.0 mtm180 38.48 34.62 0.08 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.632 0.729 . . . . 0.0 110.102 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -138.35 169.12 18.35 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.054 0.931 . . . . 0.0 110.359 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -85.3 135.37 33.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.635 0.731 . . . . 0.0 109.891 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -147.37 147.64 28.94 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.377 -0.827 . . . . 0.0 109.493 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -38.19 109.21 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 C-N-CA 122.685 2.257 . . . . 0.0 111.65 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -109.05 112.0 23.94 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.16 145.7 37.84 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.529 -0.732 . . . . 0.0 109.424 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.92 124.87 49.25 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -112.36 133.26 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-O 121.461 0.648 . . . . 0.0 109.797 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.99 138.33 43.89 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.613 0.721 . . . . 0.0 109.355 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -83.28 134.76 34.92 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.707 0.765 . . . . 0.0 110.267 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.1 t . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.732 0.777 . . . . 0.0 110.5 -179.727 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.76 151.96 52.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.71 2.274 . . . . 0.0 112.984 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.509 HD11 ' HB2' ' A' ' 80' ' ' ASP . 4.2 mp -118.38 130.89 24.49 Favored Pre-proline 0 N--CA 1.495 1.78 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.04 145.98 45.88 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.523 2.148 . . . . 0.0 112.246 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.9 t -116.52 137.13 52.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.703 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -138.22 167.65 21.38 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.309 0.576 . . . . 0.0 109.666 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -126.83 145.21 52.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.48 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 81.6 Cg_exo -43.2 -26.31 0.82 Allowed 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.24 1.96 . . . . 0.0 111.574 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -69.73 160.4 31.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.744 . . . . 0.0 110.515 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 46' ' ' PRO . 73.2 m-85 -128.37 146.55 50.74 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.544 0.688 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.518 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 71.8 m-85 -148.55 121.91 9.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.469 -0.769 . . . . 0.0 109.877 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -82.59 -20.18 36.98 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -81.77 136.31 35.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.34 -0.85 . . . . 0.0 109.881 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.86 -40.58 72.23 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.61 0.719 . . . . 0.0 109.778 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.96 99.23 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.411 -0.806 . . . . 0.0 109.807 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.518 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 54.1 t0 -65.26 -39.63 92.9 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.41 -0.806 . . . . 0.0 109.906 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.1 95.0 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.261 -0.899 . . . . 0.0 109.839 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.94 -46.02 76.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.31 -0.869 . . . . 0.0 109.858 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.57 -44.3 91.12 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.236 -0.915 . . . . 0.0 109.95 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.3 t -66.83 -41.71 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.496 -0.752 . . . . 0.0 109.906 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 88.2 p -56.95 -41.28 78.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.325 -0.86 . . . . 0.0 109.989 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.12 -45.76 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.023 -1.048 . . . . 0.0 109.66 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.52 -53.72 26.17 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.271 -0.893 . . . . 0.0 109.929 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.7 m -62.95 -35.66 80.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.387 -0.821 . . . . 0.0 109.809 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.51 ' HB2' ' O ' ' A' ' 59' ' ' SER . . . -55.65 -43.26 76.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.165 -0.96 . . . . 0.0 108.818 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -63.16 -39.66 95.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 0.0 108.747 179.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -64.92 -43.62 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.308 -0.87 . . . . 0.0 108.736 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.0 mm -64.29 -43.93 97.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.725 0.774 . . . . 0.0 109.555 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -64.21 -44.24 97.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 O-C-N 121.464 -0.772 . . . . 0.0 109.4 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -64.88 -45.22 86.9 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.81 0.814 . . . . 0.0 109.554 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -62.78 -38.95 92.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.429 -0.794 . . . . 0.0 109.868 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.499 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 79.4 t60 -60.82 -40.95 94.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.21 -0.931 . . . . 0.0 109.852 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.09 -41.73 99.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.373 -0.829 . . . . 0.0 109.823 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.16 -0.962 . . . . 0.0 108.991 179.657 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.499 ' O ' ' CE1' ' A' ' 70' ' ' HIS . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.3 mt 59.65 1.16 0.27 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.724 -0.868 . . . . 0.0 109.58 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.17 -34.46 78.13 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.483 -0.761 . . . . 0.0 109.431 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.509 ' HB2' HD11 ' A' ' 41' ' ' ILE . 98.5 m-20 -61.98 -41.05 97.6 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.251 -0.906 . . . . 0.0 109.794 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.53 -40.32 96.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.301 -0.875 . . . . 0.0 109.477 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 -179.899 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.498 0.666 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.18 137.42 51.48 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.696 0.76 . . . . 0.0 109.792 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -82.25 151.2 26.92 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.614 0.721 . . . . 0.0 110.086 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -154.51 111.84 3.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.445 ' NH2' ' CD1' ' A' ' 71' ' ' LEU . 84.1 mtp180 49.75 35.59 9.33 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.69 0.757 . . . . 0.0 110.534 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.32 -5.76 83.87 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -105.41 137.34 43.37 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.239 -1.154 . . . . 0.0 110.252 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -89.22 144.85 25.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.746 -0.596 . . . . 0.0 109.461 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.74 130.04 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-O 121.424 0.63 . . . . 0.0 109.391 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.594 ' O ' ' HB1' ' A' ' 28' ' ' ALA . 49.6 tt0 -121.26 117.95 30.27 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.98 154.22 42.44 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.609 2.206 . . . . 0.0 113.023 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.43 -167.3 39.2 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -151.07 156.01 40.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.511 -0.993 . . . . 0.0 109.509 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 57.4 tt0 -152.98 154.1 34.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.544 -0.723 . . . . 0.0 109.08 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -107.95 123.92 49.36 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.777 0.799 . . . . 0.0 110.159 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -96.92 138.3 34.68 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.797 0.808 . . . . 0.0 109.41 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -86.94 -24.29 24.82 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 109.41 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.32 -44.91 93.6 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.432 -0.793 . . . . 0.0 109.543 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.433 ' O ' ' C ' ' A' ' 22' ' ' ARG . 19.7 pt -105.6 9.99 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.449 -0.782 . . . . 0.0 108.994 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.433 ' C ' ' O ' ' A' ' 21' ' ' ILE . 51.8 ptt85 35.8 41.78 0.12 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.655 0.741 . . . . 0.0 110.803 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -146.71 160.63 41.99 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.312 -0.868 . . . . 0.0 110.427 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -85.54 137.48 32.85 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 121.536 0.684 . . . . 0.0 109.854 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.3 m -139.39 151.63 67.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.673 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -45.42 134.3 12.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.429 2.086 . . . . 0.0 112.223 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 71.9 t80 -140.31 113.81 8.64 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.378 -0.826 . . . . 0.0 109.56 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.594 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -138.69 151.12 46.89 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.584 0.707 . . . . 0.0 109.267 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.8 mt -101.74 128.34 48.11 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.481 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 95.1 mt -108.62 129.55 62.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -117.04 136.11 53.21 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.717 0.77 . . . . 0.0 109.356 -179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -101.89 117.91 35.83 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.759 0.79 . . . . 0.0 109.323 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 6.4 t . . . . . 0 C--N 1.3 -1.583 0 CA-C-O 121.606 0.717 . . . . 0.0 109.881 -179.903 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.58 131.75 17.86 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.509 2.139 . . . . 0.0 112.623 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.49 106.63 52.23 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.783 -0.573 . . . . 0.0 109.583 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.478 ' CB ' ' CE1' ' A' ' 27' ' ' TYR . 59.4 Cg_endo -75.6 146.73 30.89 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.472 2.114 . . . . 0.0 112.242 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.15 132.37 53.68 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.612 0.72 . . . . 0.0 109.715 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 p -136.41 167.13 21.91 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.389 0.614 . . . . 0.0 109.605 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -131.65 142.14 44.2 Favored Pre-proline 0 N--CA 1.492 1.657 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -45.98 -35.26 14.03 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.197 1.931 . . . . 0.0 111.576 178.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.48 144.67 56.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.52 -0.738 . . . . 0.0 110.01 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -125.51 148.11 49.0 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.66 0.743 . . . . 0.0 109.847 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.67 129.85 33.39 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.745 0.783 . . . . 0.0 109.497 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 64.7 t0 -66.86 -35.66 80.54 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.563 0.697 . . . . 0.0 109.523 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 72.4 mt -75.21 135.41 41.03 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.953 0.882 . . . . 0.0 110.342 -179.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 56' ' ' GLU . 1.7 tm-20 -72.47 -40.05 67.25 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.717 0.77 . . . . 0.0 109.715 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.2 96.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.394 -0.816 . . . . 0.0 109.872 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -64.17 -36.49 84.21 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.323 -0.86 . . . . 0.0 109.25 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.64 89.68 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.403 -0.811 . . . . 0.0 109.182 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 52' ' ' GLU . 97.2 mt-10 -64.39 -45.3 88.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.433 -0.792 . . . . 0.0 109.491 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -64.32 -43.86 93.37 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.375 -0.828 . . . . 0.0 109.677 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.3 -41.55 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.495 -0.753 . . . . 0.0 109.577 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 95.3 p -57.53 -40.38 78.68 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.409 -0.807 . . . . 0.0 109.686 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.78 -46.07 93.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.187 -0.946 . . . . 0.0 109.471 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.75 -52.64 41.91 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.118 -0.988 . . . . 0.0 109.4 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 92.6 m -59.53 -40.28 86.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.314 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 59' ' ' SER . . . -52.97 -40.13 63.5 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.559 -0.713 . . . . 0.0 109.69 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -61.51 -41.18 96.92 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.222 -0.924 . . . . 0.0 109.311 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.527 ' N ' HD12 ' A' ' 65' ' ' ILE . 1.4 mp -63.92 -43.85 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.26 -0.9 . . . . 0.0 109.542 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.89 -43.22 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.26 -0.9 . . . . 0.0 109.131 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.3 mt -62.77 -43.78 99.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.213 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -64.32 -43.73 93.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.399 -0.813 . . . . 0.0 109.395 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -63.57 -35.92 82.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.443 -0.785 . . . . 0.0 109.389 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.527 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 64.0 t60 -58.83 -42.86 90.25 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.365 -0.834 . . . . 0.0 109.621 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.445 ' CD1' ' NH2' ' A' ' 7' ' ' ARG . 96.3 mt -63.72 -41.25 98.11 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.356 -0.84 . . . . 0.0 109.093 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 t70 . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 109.229 179.837 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 77' ' ' GLY . 47.5 mt 37.63 34.59 0.05 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.83 0.824 . . . . 0.0 109.575 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.97 85.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.498 -0.751 . . . . 0.0 109.741 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -64.82 -35.43 81.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.213 -0.93 . . . . 0.0 109.186 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.96 -4.41 58.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.209 -0.932 . . . . 0.0 109.257 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.468 0 CA-C-O 117.881 -1.51 . . . . 0.0 109.566 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.497 1.911 0 CA-C-O 121.427 0.632 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.92 159.33 15.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.435 -0.791 . . . . 0.0 109.248 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.6 m170 -109.73 143.45 39.51 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.471 -0.768 . . . . 0.0 109.556 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -152.83 124.38 7.74 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.296 -0.878 . . . . 0.0 109.308 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 53.74 26.04 5.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.621 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.31 2.24 87.76 Favored Glycine 0 N--CA 1.495 2.619 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.94 140.58 38.73 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.35 -1.088 . . . . 0.0 109.554 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.514 -0.741 . . . . 0.0 109.41 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -124.76 130.01 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -114.98 113.29 44.19 Favored Pre-proline 0 N--CA 1.497 1.925 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.82 157.34 47.82 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.815 1.677 . . . . 0.0 112.79 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.7 -163.78 37.48 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -148.92 146.3 27.81 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.065 -1.256 . . . . 0.0 109.511 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.48 ' CD ' ' N ' ' A' ' 17' ' ' TYR . 6.5 tm0? -167.61 147.29 5.06 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.31 -0.868 . . . . 0.0 109.087 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.48 ' N ' ' CD ' ' A' ' 16' ' ' GLN . 49.5 p90 -107.63 137.86 44.9 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.4 mtp180 -89.04 136.04 33.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.929 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -71.07 -18.99 62.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -62.21 -45.46 93.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.322 -0.861 . . . . 0.0 109.744 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.11 -2.36 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 48.32 50.27 16.73 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.582 -0.699 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -139.55 157.28 46.08 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.408 -0.808 . . . . 0.0 109.07 178.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -85.73 131.66 34.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.626 -0.672 . . . . 0.0 109.78 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.0 148.75 36.63 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.252 -0.905 . . . . 0.0 109.344 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.74 110.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.325 2.016 . . . . 0.0 111.608 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -108.07 113.2 26.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.153 -0.967 . . . . 0.0 109.234 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.55 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -137.49 154.3 49.91 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.4 -0.813 . . . . 0.0 108.858 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.7 mt -109.69 129.64 55.59 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.6 mt -107.23 128.64 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.683 -0.636 . . . . 0.0 109.399 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -130.43 138.48 50.34 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -82.41 137.98 34.56 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.405 -0.81 . . . . 0.0 109.498 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.1 t . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.403 -0.811 . . . . 0.0 109.851 -179.381 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.63 143.42 68.91 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.124 1.882 . . . . 0.0 112.326 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 24.2 mm -106.01 130.76 22.48 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.313 -0.867 . . . . 0.0 108.734 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.2 148.49 39.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.763 1.642 . . . . 0.0 112.121 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.55 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 10.2 t -120.43 133.58 55.4 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.3 p -136.19 167.75 20.69 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -128.33 143.72 49.18 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.542 -0.724 . . . . 0.0 109.388 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -44.04 -27.36 1.75 Allowed 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 121.939 1.759 . . . . 0.0 112.008 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.24 165.01 14.67 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.396 -0.815 . . . . 0.0 109.917 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -128.4 148.06 50.68 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -150.61 110.88 4.17 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.084 -1.01 . . . . 0.0 109.667 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 68.3 t0 -66.69 -33.58 75.95 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.692 -0.63 . . . . 0.0 109.938 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.0 mt -79.35 138.19 37.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.165 -0.96 . . . . 0.0 110.953 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -70.74 -36.88 73.36 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.567 0.699 . . . . 0.0 109.416 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.29 -49.26 77.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.91 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.59 -36.18 83.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.381 -0.824 . . . . 0.0 108.938 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.25 97.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.33 -0.856 . . . . 0.0 109.563 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.16 -50.02 65.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.271 -0.893 . . . . 0.0 110.194 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -62.92 -44.57 95.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.281 -0.887 . . . . 0.0 109.647 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.28 -42.39 93.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.351 -0.843 . . . . 0.0 109.733 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.532 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 93.8 p -55.82 -40.51 72.87 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.711 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.403 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.4 mt -64.3 -45.32 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.053 -1.029 . . . . 0.0 109.457 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.31 -49.19 62.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.351 -0.843 . . . . 0.0 109.681 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.9 m -62.91 -34.79 78.18 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.529 -0.732 . . . . 0.0 109.436 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.8 -41.8 92.02 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.377 -0.827 . . . . 0.0 109.353 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.403 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 64.7 mttp -62.92 -44.7 95.37 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.197 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.59 -43.51 86.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.481 -0.762 . . . . 0.0 109.21 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.1 mm -62.31 -44.74 99.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.55 -45.05 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.035 -1.041 . . . . 0.0 109.603 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -67.08 -51.59 52.48 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.863 . . . . 0.0 109.741 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.9 m -62.09 -41.45 98.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 109.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.702 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 55.7 t60 -53.19 -43.79 67.43 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.376 -0.827 . . . . 0.0 109.432 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.4 mt -62.61 -42.03 99.33 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.352 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 p30 . . . . . 0 N--CA 1.497 1.908 0 O-C-N 121.36 -0.837 . . . . 0.0 109.997 -179.917 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.493 2.452 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.702 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 45.8 mt -73.61 37.03 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.129 -1.218 . . . . 0.0 110.21 -178.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -65.44 -35.62 81.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.362 -0.837 . . . . 0.0 109.768 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -62.57 -35.44 79.52 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.383 -0.823 . . . . 0.0 108.986 -179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.24 -2.64 53.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.409 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.584 179.734 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 m . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 121.514 0.673 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.56 138.23 50.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.586 0.708 . . . . 0.0 109.478 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -91.67 138.91 31.18 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.524 0.678 . . . . 0.0 110.04 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -149.4 121.87 8.51 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.532 -0.73 . . . . 0.0 109.608 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 52.89 29.17 7.36 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.623 0.725 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.97 1.37 88.83 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -105.06 139.86 39.1 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.458 -1.025 . . . . 0.0 109.895 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -87.4 139.67 30.32 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.9 mt -123.16 129.83 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 121.387 0.613 . . . . 0.0 109.463 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -121.05 92.46 48.51 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.68 148.35 22.76 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.759 2.306 . . . . 0.0 112.801 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.95 161.83 29.77 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -93.88 124.98 38.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.642 -0.917 . . . . 0.0 109.921 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -149.4 153.53 37.51 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.613 -0.679 . . . . 0.0 109.514 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -108.32 136.74 47.46 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.614 0.721 . . . . 0.0 109.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -96.39 138.74 33.53 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.631 0.729 . . . . 0.0 109.756 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.72 -24.59 65.39 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.542 0.687 . . . . 0.0 109.804 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -61.09 -45.1 96.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 110.335 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.9 pt -110.25 -5.07 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.404 -0.81 . . . . 0.0 109.313 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 49.14 42.23 20.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.658 0.742 . . . . 0.0 109.873 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -144.57 165.4 28.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 110.098 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -85.26 128.31 34.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.619 0.723 . . . . 0.0 110.043 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.7 m -146.82 148.07 31.85 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.531 -0.73 . . . . 0.0 109.192 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -40.93 110.31 0.12 Allowed 'Trans proline' 0 C--N 1.315 -1.223 0 C-N-CA 122.503 2.135 . . . . 0.0 112.091 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.415 ' OH ' HD21 ' A' ' 29' ' ' LEU . 82.1 t80 -114.59 119.87 38.24 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.722 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -138.67 145.05 39.94 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.61 -0.681 . . . . 0.0 109.259 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.415 HD21 ' OH ' ' A' ' 27' ' ' TYR . 64.4 mt -106.27 131.93 52.91 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -114.7 127.46 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 CA-C-O 121.374 0.607 . . . . 0.0 109.487 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -134.26 133.97 41.4 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.451 0.643 . . . . 0.0 109.267 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -81.97 137.63 35.1 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.643 0.735 . . . . 0.0 110.15 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.0 t . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.607 0.717 . . . . 0.0 110.192 -179.763 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.59 143.66 77.96 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.77 2.313 . . . . 0.0 112.528 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.5 ' N ' HD12 ' A' ' 41' ' ' ILE . 3.7 mp -116.38 130.96 24.09 Favored Pre-proline 0 N--CA 1.491 1.593 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.51 149.01 38.54 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.469 2.113 . . . . 0.0 112.461 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.722 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.5 OUTLIER -111.09 133.01 53.79 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -134.85 162.06 33.47 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.611 0.72 . . . . 0.0 109.574 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.623 ' O ' ' N ' ' A' ' 47' ' ' GLU . 12.9 t80 -143.15 135.25 13.19 Favored Pre-proline 0 N--CA 1.487 1.416 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -43.29 76.73 0.01 OUTLIER 'Trans proline' 0 N--CA 1.499 1.797 0 C-N-CA 122.857 2.371 . . . . 0.0 112.207 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.623 ' N ' ' O ' ' A' ' 45' ' ' TYR . 71.1 mm-40 -148.91 148.39 29.78 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.481 -0.762 . . . . 0.0 109.387 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -127.31 118.91 25.1 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -140.51 131.1 25.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.636 -0.665 . . . . 0.0 109.812 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -91.35 -25.43 19.4 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -76.16 143.6 41.06 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.64 0.733 . . . . 0.0 109.972 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -73.1 -40.64 64.82 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.43 0.633 . . . . 0.0 110.176 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.05 92.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.368 -0.832 . . . . 0.0 109.853 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.11 -42.49 96.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.359 -0.838 . . . . 0.0 109.839 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.76 -43.57 88.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.387 -0.821 . . . . 0.0 109.825 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.99 -44.89 75.58 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.804 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -63.85 -45.56 88.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.477 -0.765 . . . . 0.0 109.725 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.13 -42.16 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.579 -0.7 . . . . 0.0 109.777 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.416 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 77.9 p -54.73 -41.62 70.58 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.442 -0.786 . . . . 0.0 109.856 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.66 -44.62 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 109.481 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.09 91.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.391 -0.818 . . . . 0.0 109.654 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.35 -46.41 73.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.326 -0.859 . . . . 0.0 109.701 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.37 -43.41 44.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.438 -0.789 . . . . 0.0 109.502 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.74 -42.59 97.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.577 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.3 -44.64 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.387 -0.821 . . . . 0.0 109.997 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.2 -44.59 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.489 -0.757 . . . . 0.0 109.314 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.4 mt -64.7 -44.33 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -66.15 -44.22 84.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.505 -0.747 . . . . 0.0 109.906 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 43.3 t -65.66 -40.36 92.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.358 -0.839 . . . . 0.0 110.1 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -59.23 -42.1 90.25 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.903 . . . . 0.0 109.673 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.8 -42.97 99.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.445 -0.784 . . . . 0.0 109.858 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 . . . . . 0 C--N 1.302 -1.496 0 O-C-N 121.382 -0.824 . . . . 0.0 109.584 -179.879 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -102.91 17.1 24.79 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.377 -1.072 . . . . 0.0 109.682 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.49 -28.3 69.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.323 -0.86 . . . . 0.0 109.335 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.456 ' HB3' HD11 ' A' ' 41' ' ' ILE . 68.0 t0 -64.16 -32.96 74.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.535 -0.728 . . . . 0.0 109.518 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.6 mt -79.59 -3.94 49.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.37 -0.831 . . . . 0.0 109.797 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.019 -1.434 . . . . 0.0 109.744 179.908 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.778 0.799 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.68 159.58 15.15 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.525 0.679 . . . . 0.0 109.775 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -111.64 152.98 27.03 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.738 0.78 . . . . 0.0 110.239 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -139.94 -134.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.671 0.748 . . . . 0.0 109.934 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -72.65 51.99 0.28 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.754 0.788 . . . . 0.0 110.067 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.87 -6.86 82.64 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -105.99 138.7 41.72 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.339 -1.095 . . . . 0.0 110.34 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -85.6 144.7 27.73 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.359 0.599 . . . . 0.0 109.498 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.9 mt -125.32 132.1 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 121.5 0.667 . . . . 0.0 109.877 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -126.03 124.29 24.63 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.1 157.18 38.25 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.608 2.205 . . . . 0.0 112.729 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.69 -169.32 42.26 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.509 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 47.4 p-80 -148.76 146.85 28.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.768 -0.842 . . . . 0.0 109.767 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -169.78 151.35 4.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -109.3 142.95 39.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 121.887 0.851 . . . . 0.0 110.261 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -94.58 136.23 35.12 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.869 0.843 . . . . 0.0 109.477 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 42.3 p30 -68.0 -20.0 64.98 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.424 0.631 . . . . 0.0 109.673 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 98.9 m-20 -62.38 -42.16 99.2 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.5 -0.75 . . . . 0.0 109.639 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.2 pt -115.56 -3.13 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.573 -0.704 . . . . 0.0 109.281 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 49.16 40.54 17.92 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.632 -0.667 . . . . 0.0 109.988 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -135.83 161.16 36.39 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.651 0.739 . . . . 0.0 110.38 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -86.44 128.33 34.94 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 121.574 0.702 . . . . 0.0 109.85 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -137.3 147.6 58.8 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.97 108.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.248 0 C-N-CA 122.631 2.221 . . . . 0.0 112.057 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -106.33 116.97 32.85 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.487 0.66 . . . . 0.0 109.645 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.733 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -135.11 141.78 46.08 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.681 0.753 . . . . 0.0 109.079 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.2 mt -105.08 127.08 52.72 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.65 0.738 . . . . 0.0 109.309 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -115.16 130.46 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.458 0.647 . . . . 0.0 109.465 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.96 134.85 47.72 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.912 0.863 . . . . 0.0 109.672 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -82.6 137.33 34.56 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.872 0.844 . . . . 0.0 110.202 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.9 t . . . . . 0 C--N 1.3 -1.57 0 CA-C-O 121.676 0.751 . . . . 0.0 110.199 -179.772 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.64 145.53 29.86 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.18 1.92 . . . . 0.0 112.427 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.9 mm -114.82 95.39 41.04 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.17 142.94 43.91 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.7 2.267 . . . . 0.0 112.447 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.733 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -107.74 138.38 44.09 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.692 0.758 . . . . 0.0 110.102 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.2 p -139.24 166.65 23.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.497 0.665 . . . . 0.0 109.48 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.59 ' O ' ' N ' ' A' ' 47' ' ' GLU . 39.9 t80 -137.66 138.29 23.9 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.33 72.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.776 0 C-N-CA 122.863 2.375 . . . . 0.0 112.337 178.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.59 ' N ' ' O ' ' A' ' 45' ' ' TYR . 17.3 pt-20 -173.06 143.45 1.15 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.393 -0.817 . . . . 0.0 109.313 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -125.2 149.61 47.78 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.678 0.752 . . . . 0.0 109.832 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -137.77 131.3 31.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.609 0.719 . . . . 0.0 109.6 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -74.1 -16.4 61.02 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -96.6 130.56 43.77 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.791 0.805 . . . . 0.0 109.443 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.509 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 83.3 tt0 -69.02 -37.36 78.6 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.262 0.553 . . . . 0.0 110.397 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.84 95.1 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.188 -0.945 . . . . 0.0 109.649 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.96 -39.84 95.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.538 -0.726 . . . . 0.0 109.432 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.79 -40.02 94.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.531 -0.731 . . . . 0.0 109.788 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.05 -48.43 68.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.441 -0.787 . . . . 0.0 110.016 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.8 ttp85 -64.11 -44.55 91.92 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.766 0.793 . . . . 0.0 109.767 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.37 -41.9 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.579 -0.7 . . . . 0.0 109.659 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.656 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 78.3 p -57.9 -40.15 79.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.46 -0.775 . . . . 0.0 109.681 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.17 -44.17 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 109.244 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.72 82.55 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.68 0.752 . . . . 0.0 109.405 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.512 ' SG ' ' N ' ' A' ' 63' ' ' ALA . 1.2 p -66.13 -36.96 84.51 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.821 0.82 . . . . 0.0 109.373 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.512 ' N ' ' SG ' ' A' ' 62' ' ' CYS . . . -60.89 -44.83 96.58 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.528 0.68 . . . . 0.0 109.473 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.96 -42.51 97.26 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.607 0.718 . . . . 0.0 109.513 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.48 -43.18 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.555 -0.716 . . . . 0.0 109.736 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.78 -43.22 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.353 -0.842 . . . . 0.0 109.652 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.4 -44.12 98.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.576 -0.703 . . . . 0.0 109.432 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -67.8 -40.54 83.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.358 -0.838 . . . . 0.0 109.314 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.8 m -63.43 -42.22 98.7 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.619 -0.675 . . . . 0.0 110.098 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.75 -47.34 85.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.251 -0.905 . . . . 0.0 109.811 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.95 -41.45 95.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.523 -0.736 . . . . 0.0 109.412 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 64.4 t0 . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 109.967 -179.568 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.523 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.179 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.2 mt 60.65 0.0 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.712 0.768 . . . . 0.0 109.244 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.523 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.44 -39.71 94.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.481 -0.762 . . . . 0.0 109.458 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -69.87 -19.48 63.43 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.1 mt -94.38 1.29 55.86 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.553 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.672 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.677 0.751 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.75 135.14 54.96 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.879 0.847 . . . . 0.0 109.965 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -88.14 136.79 32.81 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.726 0.774 . . . . 0.0 110.035 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -149.8 125.02 10.1 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.748 0.785 . . . . 0.0 109.569 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.539 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 23.6 mmt85 54.18 25.8 6.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.42 0.628 . . . . 0.0 109.867 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.72 3.62 83.43 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -107.63 141.24 39.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.859 0.837 . . . . 0.0 110.307 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.6 144.85 27.64 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.8 mt -124.0 129.4 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.714 0.769 . . . . 0.0 110.013 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -129.61 96.54 26.76 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.41 159.63 32.57 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.956 2.438 . . . . 0.0 113.118 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.32 126.86 0.94 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.629 ' NE2' ' CD2' ' A' ' 24' ' ' TYR . 0.3 OUTLIER -67.81 140.74 56.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.639 -0.918 . . . . 0.0 109.987 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.596 ' N ' ' ND1' ' A' ' 15' ' ' HIS . 58.6 tt0 -165.18 150.96 9.68 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 121.815 0.817 . . . . 0.0 109.753 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.55 137.67 40.48 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.793 0.806 . . . . 0.0 109.79 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp85 -97.64 135.73 39.03 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.902 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.0 p-10 -71.86 -18.06 62.09 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.93 -42.29 97.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.699 -0.626 . . . . 0.0 109.436 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 pt -113.57 -7.59 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 51.32 51.3 17.16 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.493 0.663 . . . . 0.0 109.608 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -146.48 169.67 18.43 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.932 0.872 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.629 ' CD2' ' NE2' ' A' ' 15' ' ' HIS . 3.2 m-85 -86.51 124.23 32.6 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.746 0.784 . . . . 0.0 109.314 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.45 155.45 39.18 Favored Pre-proline 0 C--N 1.302 -1.464 0 CA-C-O 121.241 0.544 . . . . 0.0 109.713 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.4 ' CB ' ' OG ' ' A' ' 59' ' ' SER . 19.4 Cg_endo -59.33 136.66 73.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.414 2.076 . . . . 0.0 111.726 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -138.52 116.87 11.94 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.409 0.623 . . . . 0.0 109.39 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -133.52 153.99 51.19 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.727 0.775 . . . . 0.0 110.206 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.8 mt -107.94 131.18 54.81 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.732 0.777 . . . . 0.0 109.845 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 89.3 mt -108.85 128.01 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 CA-C-O 121.716 0.77 . . . . 0.0 109.446 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -135.67 134.96 39.73 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.734 0.778 . . . . 0.0 109.836 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -86.83 134.87 33.51 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.751 0.786 . . . . 0.0 109.994 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 78.7 t . . . . . 0 C--N 1.301 -1.538 0 CA-C-O 121.749 0.785 . . . . 0.0 110.503 -179.498 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.24 133.4 21.06 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.445 2.096 . . . . 0.0 112.349 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 35.5 mm -115.9 84.48 13.25 Favored Pre-proline 0 N--CA 1.495 1.803 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -70.32 144.57 51.45 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 122.539 2.159 . . . . 0.0 112.55 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.7 t -105.39 135.27 47.08 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.902 0.858 . . . . 0.0 109.757 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 166.73 22.37 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.701 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.456 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.1 OUTLIER -126.03 146.93 57.4 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -70.62 -12.08 30.71 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 122.628 2.218 . . . . 0.0 111.513 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -78.01 -178.1 5.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.607 -0.683 . . . . 0.0 110.021 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -130.44 147.58 52.16 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.903 0.859 . . . . 0.0 109.984 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -149.34 98.24 2.77 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.615 0.722 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -71.26 -17.3 62.49 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.1 mt -91.27 132.34 36.2 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.807 0.813 . . . . 0.0 109.754 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -67.83 -39.51 83.89 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.8 75.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.683 -0.636 . . . . 0.0 109.927 -179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.84 -38.67 91.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.536 -0.728 . . . . 0.0 109.236 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.92 98.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.754 -0.591 . . . . 0.0 109.419 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -68.14 -47.09 69.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.747 -0.596 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -64.51 -44.05 92.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.604 -0.685 . . . . 0.0 109.665 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.434 HG12 ' SG ' ' A' ' 62' ' ' CYS . 69.7 t -67.76 -40.74 84.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.682 -0.636 . . . . 0.0 109.344 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.4 ' OG ' ' CB ' ' A' ' 26' ' ' PRO . 64.1 m -54.47 -44.81 72.92 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.543 -0.723 . . . . 0.0 109.684 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.596 -0.69 . . . . 0.0 109.375 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.19 95.02 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.767 -0.583 . . . . 0.0 109.757 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.456 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 86.5 m -67.6 -49.4 63.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.515 -0.741 . . . . 0.0 109.602 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.38 15.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.642 -0.661 . . . . 0.0 109.585 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -65.23 -41.22 94.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.735 -0.603 . . . . 0.0 109.445 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.52 -43.75 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.619 -0.676 . . . . 0.0 109.948 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.03 -44.63 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.99 -44.54 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.602 -0.687 . . . . 0.0 109.449 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.539 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 93.0 m-20 -66.32 -43.73 85.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.473 -0.767 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.3 p -65.78 -37.46 86.38 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.721 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 84.9 t60 -58.48 -40.71 83.49 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.2 mt -63.84 -41.44 97.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.735 -0.603 . . . . 0.0 109.422 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 N--CA 1.495 1.787 0 O-C-N 121.652 -0.655 . . . . 0.0 109.742 -179.642 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.721 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 86.6 mt -95.83 12.1 31.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.339 -1.095 . . . . 0.0 108.801 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.73 -39.58 94.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.775 -0.578 . . . . 0.0 109.49 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -65.38 -35.72 81.82 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.477 -0.764 . . . . 0.0 109.0 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 87.2 mt -86.22 -5.2 59.24 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.806 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 -179.687 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.313 0.578 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.89 163.71 13.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.109 -0.995 . . . . 0.0 109.528 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -118.65 144.47 46.15 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.677 -0.64 . . . . 0.0 109.471 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -153.04 119.85 5.71 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.276 -0.89 . . . . 0.0 109.713 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 52.28 31.06 8.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.468 -0.77 . . . . 0.0 110.151 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.67 3.32 83.84 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 120.142 -1.028 . . . . 0.0 110.663 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -106.26 136.26 46.3 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.238 -1.154 . . . . 0.0 109.52 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -91.17 145.64 24.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.273 -0.892 . . . . 0.0 108.984 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.1 mt -118.72 128.64 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.684 -0.635 . . . . 0.0 109.709 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -123.8 94.16 46.32 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.08 162.14 32.01 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.868 1.712 . . . . 0.0 112.76 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.533 ' O ' ' ND1' ' A' ' 15' ' ' HIS . . . 179.5 -25.1 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.533 ' ND1' ' O ' ' A' ' 14' ' ' GLY . 0.1 OUTLIER 74.22 155.4 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.532 -0.981 . . . . 0.0 109.723 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -170.44 155.93 5.32 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -105.64 137.12 44.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.362 -0.836 . . . . 0.0 108.788 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -94.26 136.04 34.99 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.149 -0.97 . . . . 0.0 109.722 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 39.8 p30 -68.77 -20.69 64.36 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.478 -0.764 . . . . 0.0 109.552 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.528 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 30.4 t70 -59.29 -49.41 77.96 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.076 -1.015 . . . . 0.0 109.234 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.4 pt -105.71 -4.07 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.453 -0.78 . . . . 0.0 109.571 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 49.0 49.05 20.05 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.69 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -145.6 165.99 27.05 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.299 -0.876 . . . . 0.0 109.593 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -88.54 127.19 35.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.54 -0.725 . . . . 0.0 109.462 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.93 153.31 49.64 Favored Pre-proline 0 N--CA 1.492 1.66 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -43.45 130.97 6.99 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 121.537 1.491 . . . . 0.0 112.096 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -150.99 113.92 4.75 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' O ' HG22 ' A' ' 43' ' ' THR . . . -141.0 163.57 32.61 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.35 -0.844 . . . . 0.0 109.668 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.0 mt -106.26 131.42 53.51 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -115.94 132.26 65.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.618 -0.677 . . . . 0.0 109.89 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -126.02 136.96 53.57 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -96.81 124.38 40.77 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 74.1 t . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.484 -0.76 . . . . 0.0 109.79 179.839 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.02 148.3 44.76 Favored 'Trans proline' 0 C--N 1.314 -1.245 0 C-N-CA 121.391 1.394 . . . . 0.0 111.296 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.4 mm -114.02 132.82 22.5 Favored Pre-proline 0 N--CA 1.498 1.935 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -74.4 150.21 40.95 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 121.752 1.635 . . . . 0.0 112.491 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -128.07 131.63 49.07 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.476 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.0 p -136.55 164.86 27.19 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.632 -0.668 . . . . 0.0 109.422 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 47' ' ' GLU . 77.7 t80 -138.12 121.63 11.39 Favored Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -43.15 82.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.196 1.931 . . . . 0.0 113.288 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 45' ' ' TYR . 47.3 tp10 -168.56 151.57 5.37 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.02 148.56 30.59 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.091 -1.005 . . . . 0.0 111.574 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.47 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 66.7 m-85 -157.05 104.76 2.1 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 25.6 p-10 -74.72 -6.39 48.53 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.177 -0.952 . . . . 0.0 110.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 84.3 mt -102.74 130.32 49.66 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.053 -1.03 . . . . 0.0 110.23 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -66.35 -40.25 89.69 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.472 -0.768 . . . . 0.0 109.279 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -50.88 71.0 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.049 -1.032 . . . . 0.0 109.47 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.47 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.7 t0 -65.47 -39.2 91.7 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.12 -0.988 . . . . 0.0 109.232 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.59 98.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.818 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.31 -43.81 85.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.05 -1.031 . . . . 0.0 109.315 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpp85 -62.53 -46.66 87.39 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.274 -0.891 . . . . 0.0 109.192 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.4 HG23 ' OD1' ' A' ' 54' ' ' ASP . 71.1 t -66.8 -42.62 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.565 -0.71 . . . . 0.0 109.781 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -56.01 -41.48 74.98 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.112 -0.993 . . . . 0.0 109.696 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.97 -44.66 97.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 O-C-N 121.134 -0.979 . . . . 0.0 109.238 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.9 -41.58 82.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.37 -39.79 85.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.302 -0.874 . . . . 0.0 109.786 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.94 -44.84 82.92 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.342 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.87 -42.1 97.6 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.144 -0.973 . . . . 0.0 109.737 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.1 mt -64.06 -43.56 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.175 -0.953 . . . . 0.0 109.629 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' A' ' 66' ' ' ILE . 30.1 mm -63.29 -43.14 98.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.295 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.87 -44.82 99.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 121.173 -0.955 . . . . 0.0 109.4 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -65.78 -45.91 80.69 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.122 -0.986 . . . . 0.0 109.15 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.5 m -62.19 -39.02 91.33 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.428 -0.795 . . . . 0.0 109.75 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.406 ' CE1' ' N ' ' A' ' 79' ' ' ALA . 86.4 t60 -58.93 -50.16 75.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.121 -0.987 . . . . 0.0 110.219 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.52 -43.23 94.69 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.086 -1.009 . . . . 0.0 109.329 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 65.8 t0 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.224 -0.922 . . . . 0.0 110.12 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 mt -94.32 31.79 1.66 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.382 -1.069 . . . . 0.0 109.496 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.406 ' N ' ' CE1' ' A' ' 70' ' ' HIS . . . -61.57 -36.2 79.95 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 0.0 109.748 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.87 -38.15 87.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.119 -0.988 . . . . 0.0 109.401 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.1 mt -83.23 -2.95 56.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.155 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 117.989 -1.451 . . . . 0.0 109.549 179.994 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 121.92 0.867 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.06 134.19 55.06 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.855 0.836 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -81.97 146.91 29.5 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.701 0.763 . . . . 0.0 110.373 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.64 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 15.8 t80 -154.32 113.95 3.78 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.582 0.706 . . . . 0.0 109.423 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.64 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 46.57 36.1 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.684 0.754 . . . . 0.0 110.184 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.11 -20.08 38.78 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 6' ' ' TYR . 93.4 m-85 -86.76 137.37 32.49 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.379 -1.071 . . . . 0.0 110.122 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -91.99 149.23 21.65 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.466 0.65 . . . . 0.0 109.312 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 90.7 mt -122.82 132.26 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 CA-C-O 121.724 0.773 . . . . 0.0 109.435 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -120.62 88.49 43.35 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.87 147.37 81.77 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.66 2.24 . . . . 0.0 112.375 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.59 -173.72 35.22 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.507 ' CD2' ' OE2' ' A' ' 52' ' ' GLU . 53.7 p-80 -141.08 122.53 15.0 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.759 0.79 . . . . 0.0 109.964 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -154.6 155.33 34.53 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.907 0.86 . . . . 0.0 110.129 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -110.53 145.94 36.88 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.683 0.754 . . . . 0.0 110.071 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.733 ' HE ' HG21 ' A' ' 44' ' ' THR . 95.0 mtt-85 -101.32 137.67 39.35 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.703 0.763 . . . . 0.0 109.756 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -68.46 -15.27 63.49 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.717 -0.614 . . . . 0.0 109.95 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -62.83 -43.26 99.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.375 -0.828 . . . . 0.0 109.362 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.8 pt -114.96 -7.92 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.1 mmm180 55.17 44.11 28.31 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.433 0.635 . . . . 0.0 110.09 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -141.3 161.08 38.74 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.616 0.722 . . . . 0.0 110.49 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.96 128.67 34.73 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.947 0.879 . . . . 0.0 109.85 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.7 m -140.19 149.18 57.27 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -37.04 108.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.315 -1.196 0 C-N-CA 122.939 2.426 . . . . 0.0 112.387 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -104.78 119.89 40.07 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.669 0.747 . . . . 0.0 109.957 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.485 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -144.86 147.64 33.04 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.835 0.826 . . . . 0.0 109.577 179.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.8 mt -109.62 133.83 52.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.621 0.724 . . . . 0.0 109.199 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 mm -103.18 123.05 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -127.94 137.31 52.22 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.9 0.857 . . . . 0.0 110.22 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -101.89 141.56 34.56 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.899 0.857 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.8 t . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 121.952 0.882 . . . . 0.0 110.637 -179.128 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -57.92 145.34 91.56 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.487 2.125 . . . . 0.0 112.515 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.543 ' N ' HD12 ' A' ' 41' ' ' ILE . 0.9 OUTLIER -127.32 89.26 51.99 Favored Pre-proline 0 N--CA 1.493 1.676 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.788 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.39 143.05 56.08 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.702 2.268 . . . . 0.0 112.833 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.485 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 14.8 t -105.32 134.83 47.77 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.821 0.819 . . . . 0.0 109.831 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.733 HG21 ' HE ' ' A' ' 18' ' ' ARG . 47.0 p -141.2 167.26 22.61 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.54 0.686 . . . . 0.0 109.871 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.578 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.5 OUTLIER -128.44 146.49 60.07 Favored Pre-proline 0 N--CA 1.486 1.367 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -48.99 -37.18 36.71 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 122.058 1.839 . . . . 0.0 111.271 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -45.55 150.55 0.48 Allowed 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.798 0.808 . . . . 0.0 110.15 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -121.85 139.6 53.42 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.822 0.82 . . . . 0.0 110.045 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.417 ' CE2' HG21 ' A' ' 58' ' ' VAL . 67.7 m-85 -141.66 111.93 6.92 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.686 0.755 . . . . 0.0 109.341 179.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.49 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 20.1 p-10 -68.32 -33.08 73.66 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.76 136.68 39.02 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.014 0.911 . . . . 0.0 109.942 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.507 ' OE2' ' CD2' ' A' ' 15' ' ' HIS . 43.6 tt0 -70.71 -37.07 73.52 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.765 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.71 -39.19 93.28 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.556 -0.715 . . . . 0.0 110.326 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -65.16 -38.97 92.25 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.45 -0.781 . . . . 0.0 109.362 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.91 89.19 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.614 -0.679 . . . . 0.0 109.819 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -66.85 -47.64 71.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.472 -0.768 . . . . 0.0 109.768 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -66.17 -44.1 85.03 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 121.47 0.652 . . . . 0.0 109.865 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.417 HG21 ' CE2' ' A' ' 49' ' ' TYR . 75.5 t -66.98 -41.28 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 109.575 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.0 p -57.87 -39.47 77.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.573 -0.704 . . . . 0.0 109.715 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.0 -45.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.62 -39.18 77.34 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.497 0.665 . . . . 0.0 109.764 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.578 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 5.9 t -70.92 -37.36 72.9 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.478 -0.764 . . . . 0.0 109.662 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.86 87.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.69 -0.631 . . . . 0.0 109.711 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -64.02 -42.93 96.96 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.563 0.697 . . . . 0.0 109.293 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.3 mt -65.36 -43.51 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.647 -0.658 . . . . 0.0 109.642 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -64.22 -44.18 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 110.104 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.2 mt -65.1 -43.68 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.642 -0.661 . . . . 0.0 109.306 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -66.24 -43.65 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.628 -0.67 . . . . 0.0 109.456 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.0 p -68.27 -36.66 79.74 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.56 0.695 . . . . 0.0 109.435 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -61.27 -45.29 95.1 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.628 -0.67 . . . . 0.0 109.76 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 81.3 mt -64.65 -42.91 95.09 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.468 0.651 . . . . 0.0 109.639 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.97 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.98 25.96 10.72 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.716 -0.873 . . . . 0.0 109.64 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.12 79.55 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.353 -0.842 . . . . 0.0 109.426 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.466 ' HB2' HD11 ' A' ' 41' ' ' ILE . 99.7 m-20 -62.5 -40.81 97.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.445 0.64 . . . . 0.0 109.64 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -84.84 -2.56 57.91 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -179.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.839 0.828 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.44 155.34 17.92 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.546 -0.721 . . . . 0.0 109.509 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -109.52 141.39 42.05 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.71 0.767 . . . . 0.0 109.947 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -153.69 122.59 6.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.41 -0.806 . . . . 0.0 109.21 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 54.83 25.91 7.17 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.634 0.73 . . . . 0.0 110.083 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.48 8.37 77.55 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -110.84 142.94 42.18 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.349 -1.089 . . . . 0.0 110.292 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -91.91 142.34 27.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.407 -0.808 . . . . 0.0 109.438 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.13 130.62 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.511 -0.743 . . . . 0.0 109.591 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -120.83 94.22 48.87 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -78.26 148.6 24.2 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.608 2.205 . . . . 0.0 113.101 -178.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.78 115.04 0.39 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -55.18 136.91 48.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -1.038 . . . . 0.0 111.034 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -153.59 149.29 27.46 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.467 -0.771 . . . . 0.0 109.32 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -106.78 134.32 50.11 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.858 0.837 . . . . 0.0 110.119 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 94.2 mtt180 -94.13 138.19 32.47 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.538 -0.726 . . . . 0.0 109.786 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -68.66 -20.74 64.47 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.531 -0.731 . . . . 0.0 109.434 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.83 -43.68 95.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.904 . . . . 0.0 109.784 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 15.1 pt -112.12 -0.31 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' ARG . 90.2 mtm-85 43.28 37.2 1.22 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.64 -0.662 . . . . 0.0 110.401 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -137.48 162.56 33.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.253 -0.905 . . . . 0.0 110.172 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -86.12 128.57 34.9 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.843 0.83 . . . . 0.0 109.85 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.5 m -145.84 147.63 33.16 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -37.27 110.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.707 2.272 . . . . 0.0 112.17 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -119.58 118.42 30.96 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.38 -0.825 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.1 155.0 44.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.312 -0.868 . . . . 0.0 109.179 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -111.08 130.28 55.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.731 . . . . 0.0 109.254 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 98.1 mt -107.11 130.65 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -134.81 138.51 44.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.501 -0.75 . . . . 0.0 109.048 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.53 137.48 32.3 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -0.812 . . . . 0.0 110.196 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 76.7 t . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 121.692 0.758 . . . . 0.0 110.39 -179.698 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.6 m . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -55.19 140.46 81.08 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.763 2.309 . . . . 0.0 112.035 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.88 131.05 24.04 Favored Pre-proline 0 N--CA 1.495 1.777 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.81 142.78 44.11 Favored 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.132 1.888 . . . . 0.0 112.494 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.8 t -119.22 130.22 55.36 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.642 0.734 . . . . 0.0 109.089 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -139.22 167.45 22.05 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.553 ' O ' ' N ' ' A' ' 47' ' ' GLU . 82.6 t80 -120.62 123.8 27.89 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.596 -0.69 . . . . 0.0 109.193 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -43.35 80.54 0.01 OUTLIER 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 122.576 2.184 . . . . 0.0 112.561 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 45' ' ' TYR . 81.2 tt0 -172.69 157.76 3.88 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.266 -0.896 . . . . 0.0 109.028 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -112.09 140.08 47.07 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.361 -0.837 . . . . 0.0 109.486 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.475 ' CZ ' ' OE2' ' A' ' 47' ' ' GLU . 37.7 m-85 -135.7 131.56 35.79 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.38 -0.825 . . . . 0.0 108.9 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -93.32 -23.95 18.3 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.83 137.76 32.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.068 -1.02 . . . . 0.0 110.181 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -71.13 -37.51 72.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.48 -0.762 . . . . 0.0 109.398 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.49 84.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 109.421 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.7 -41.46 98.12 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.405 -0.81 . . . . 0.0 109.506 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.2 96.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 109.981 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.85 -44.25 70.24 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.118 -0.989 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -67.68 -43.01 81.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.162 -0.961 . . . . 0.0 110.027 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.92 -42.68 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.709 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -60.35 -42.15 95.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.623 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 93.7 mt -65.52 -44.47 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.147 -0.971 . . . . 0.0 109.691 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.71 -39.3 80.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.053 -1.03 . . . . 0.0 109.211 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.8 t -69.54 -38.37 77.48 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.406 -0.809 . . . . 0.0 109.625 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.9 -46.13 85.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.48 -43.82 96.21 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.118 -0.989 . . . . 0.0 109.455 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.57 -43.06 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.908 . . . . 0.0 109.394 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.44 -44.05 98.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.177 -0.952 . . . . 0.0 109.586 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.02 -44.48 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.216 -0.928 . . . . 0.0 109.447 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -66.4 -41.98 88.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.431 -0.793 . . . . 0.0 109.878 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.8 p -67.63 -35.73 79.47 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.237 -0.914 . . . . 0.0 109.692 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.649 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 80.9 t60 -60.64 -43.86 97.08 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.334 -0.854 . . . . 0.0 109.61 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.87 -41.78 97.69 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.863 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.17 -0.956 . . . . 0.0 110.24 -179.45 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.59 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.649 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 25.1 mt -108.36 24.85 12.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.466 -1.02 . . . . 0.0 109.476 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.86 89.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -64.58 -35.63 81.62 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.306 -0.871 . . . . 0.0 109.485 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 85.1 mt -83.27 14.74 3.33 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.217 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.6 m . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 121.517 0.675 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.8 157.35 16.18 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -0.842 . . . . 0.0 109.978 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.22 143.43 41.99 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.67 -0.644 . . . . 0.0 109.528 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -155.47 126.3 6.99 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.435 -0.791 . . . . 0.0 109.448 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.427 HH21 HD13 ' A' ' 71' ' ' LEU . 22.1 mmm180 53.22 24.75 3.88 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.705 0.764 . . . . 0.0 109.615 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 33' ' ' VAL . . . 89.63 -16.67 55.89 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -84.9 143.17 29.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -1.102 . . . . 0.0 110.49 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -90.12 143.94 26.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.468 -0.77 . . . . 0.0 109.063 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.5 mt -124.3 129.9 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.611 -0.68 . . . . 0.0 109.275 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.497 ' O ' ' HB1' ' A' ' 28' ' ' ALA . 31.7 mt-10 -115.5 126.34 27.85 Favored Pre-proline 0 N--CA 1.492 1.663 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.93 158.45 38.54 Favored 'Trans proline' 0 N--CA 1.495 1.588 0 C-N-CA 122.351 2.034 . . . . 0.0 113.098 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.3 -176.6 45.26 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -147.79 124.53 11.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.347 -1.09 . . . . 0.0 109.015 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -146.12 157.46 43.84 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.924 . . . . 0.0 109.06 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -106.5 145.9 31.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.624 -0.672 . . . . 0.0 110.175 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.422 HH21 ' CD1' ' A' ' 21' ' ' ILE . 88.9 mtm180 -92.87 140.03 29.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.459 -0.776 . . . . 0.0 110.117 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -67.44 -28.46 67.91 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.396 -0.815 . . . . 0.0 109.534 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -60.26 -49.02 79.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.463 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.422 ' CD1' HH21 ' A' ' 18' ' ' ARG . 18.7 pt -106.29 0.03 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.493 -0.755 . . . . 0.0 109.502 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 43.19 44.71 4.55 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.413 -0.805 . . . . 0.0 109.833 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -137.92 161.41 36.72 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.397 -0.814 . . . . 0.0 110.081 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -84.32 133.41 34.54 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.572 0.701 . . . . 0.0 110.171 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.6 155.25 41.77 Favored Pre-proline 0 N--CA 1.487 1.395 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -42.42 120.47 1.68 Allowed 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 122.167 1.911 . . . . 0.0 111.9 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -126.18 127.98 46.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.704 -0.623 . . . . 0.0 109.747 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -150.99 157.69 43.19 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.307 -0.871 . . . . 0.0 109.2 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 86.0 mt -106.63 135.34 48.32 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -117.35 132.03 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.82 -0.55 . . . . 0.0 109.809 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -131.84 138.6 48.55 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.5 0.667 . . . . 0.0 109.403 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -83.48 135.97 34.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.513 -0.742 . . . . 0.0 110.058 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 8' ' ' GLY . 91.3 t . . . . . 0 N--CA 1.489 1.485 0 O-C-N 121.421 -0.8 . . . . 0.0 110.045 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.42 ' O ' ' OD2' ' A' ' 80' ' ' ASP . 9.8 m . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.05 146.05 28.63 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 121.957 1.771 . . . . 0.0 112.52 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.413 HD11 ' OD2' ' A' ' 80' ' ' ASP . 31.7 mm -115.07 93.74 36.11 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.25 140.64 51.54 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.13 1.887 . . . . 0.0 112.068 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 t -99.03 136.14 39.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.422 -0.799 . . . . 0.0 109.631 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -132.47 161.06 34.69 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.541 ' O ' ' O ' ' A' ' 46' ' ' PRO . 4.4 t80 -142.03 140.62 19.87 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 45' ' ' TYR . 76.7 Cg_exo -46.24 -131.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.974 2.449 . . . . 0.0 113.39 178.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' PRO . 58.8 mp0 44.29 -170.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.097 -1.002 . . . . 0.0 110.468 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 49' ' ' TYR . 71.2 m-85 -145.7 149.3 34.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.145 -0.972 . . . . 0.0 109.8 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.413 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 64.1 m-85 -146.9 105.94 3.87 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.475 -0.766 . . . . 0.0 109.133 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -72.65 -17.59 61.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.4 mt -96.53 126.73 41.92 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.81 0.814 . . . . 0.0 109.92 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -69.37 -38.06 77.87 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.457 0.646 . . . . 0.0 109.811 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -46.63 87.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.369 -0.832 . . . . 0.0 109.745 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -65.2 -36.03 82.9 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.486 -0.759 . . . . 0.0 109.475 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.33 -38.74 92.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.315 -0.866 . . . . 0.0 109.433 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.77 -48.07 78.41 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.883 . . . . 0.0 109.594 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -46.1 89.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 109.289 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.8 t -64.0 -42.69 96.5 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.729 -0.607 . . . . 0.0 109.524 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.477 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 45.6 m -55.25 -39.94 70.36 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.079 -1.013 . . . . 0.0 109.566 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.499 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.2 mt -64.03 -44.99 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 120.96 -1.088 . . . . 0.0 109.098 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.92 79.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.9 . . . . 0.0 109.737 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.5 m -66.75 -38.29 86.32 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.286 -0.884 . . . . 0.0 109.172 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.8 -43.57 77.0 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.405 -0.809 . . . . 0.0 109.212 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.499 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 33.5 mtmm -62.84 -42.17 99.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.105 -0.997 . . . . 0.0 109.532 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.07 -43.44 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.43 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.63 -43.57 98.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.297 -0.877 . . . . 0.0 109.591 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.23 -45.15 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.035 -1.04 . . . . 0.0 109.557 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.83 -41.69 97.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 t -65.95 -37.91 87.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.289 -0.882 . . . . 0.0 109.425 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.65 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 81.7 t60 -56.39 -45.12 80.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.217 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.427 HD13 HH21 ' A' ' 7' ' ' ARG . 64.9 mt -65.13 -38.48 90.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.363 -0.836 . . . . 0.0 109.543 179.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 63.5 t0 . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.884 -179.485 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.474 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.65 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 42.8 mt -111.01 31.77 5.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.48 -1.011 . . . . 0.0 109.462 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.44 -36.67 84.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.902 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.42 ' OD2' ' O ' ' A' ' 39' ' ' THR . 21.3 p-10 -59.6 -45.84 90.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 109.893 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.52 -41.45 96.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 0.0 110.197 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 CA-C-O 117.87 -1.517 . . . . 0.0 109.574 -179.642 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.849 0.833 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.43 160.33 14.85 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.67 0.747 . . . . 0.0 110.094 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -108.0 147.17 31.47 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.778 0.799 . . . . 0.0 109.812 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -151.71 119.11 5.99 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.864 0.84 . . . . 0.0 110.051 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.434 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.7 mtp180 45.85 32.09 1.21 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.441 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.22 -23.03 35.33 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -84.03 141.47 31.15 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.516 -0.99 . . . . 0.0 110.317 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -94.3 140.08 30.25 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.742 0.782 . . . . 0.0 109.697 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -116.75 128.89 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.678 0.752 . . . . 0.0 109.719 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -123.97 96.49 42.46 Favored Pre-proline 0 N--CA 1.492 1.645 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.13 154.7 37.47 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 122.874 2.383 . . . . 0.0 112.689 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.8 95.75 0.11 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -47.43 146.74 1.93 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.791 -0.829 . . . . 0.0 109.919 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -146.98 157.99 43.79 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.872 0.844 . . . . 0.0 109.799 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -101.34 119.94 39.52 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.733 0.777 . . . . 0.0 109.615 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -95.78 137.86 34.25 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.828 0.823 . . . . 0.0 110.001 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.94 -24.3 41.12 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -62.6 -44.81 95.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.59 -0.693 . . . . 0.0 109.626 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.3 pt -106.98 1.27 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.46 -0.775 . . . . 0.0 109.279 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 42.95 39.59 1.83 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.594 0.711 . . . . 0.0 109.689 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HG3' ' H ' ' A' ' 24' ' ' TYR . 29.4 tptt -145.88 161.46 39.96 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.774 0.797 . . . . 0.0 110.21 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.402 ' H ' ' HG3' ' A' ' 23' ' ' LYS . 95.7 m-85 -85.96 132.7 34.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.916 0.865 . . . . 0.0 109.449 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.6 m -148.1 148.44 29.55 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.796 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.47 110.42 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.745 2.296 . . . . 0.0 111.868 178.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.8 121.44 40.8 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.812 0.815 . . . . 0.0 109.837 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.53 ' O ' HG22 ' A' ' 43' ' ' THR . . . -143.03 154.11 43.65 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.692 0.758 . . . . 0.0 109.995 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.4 mt -111.4 129.43 56.02 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.695 0.759 . . . . 0.0 109.321 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -108.81 130.22 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.712 0.768 . . . . 0.0 109.813 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -130.57 130.83 44.56 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.847 0.832 . . . . 0.0 109.704 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -84.76 135.87 33.94 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.841 0.829 . . . . 0.0 109.837 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 73.1 t . . . . . 0 C--N 1.302 -1.48 0 CA-C-O 121.754 0.788 . . . . 0.0 110.124 -179.781 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.484 1.255 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 147.32 34.2 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.367 2.045 . . . . 0.0 112.531 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -114.23 126.49 27.93 Favored Pre-proline 0 N--CA 1.487 1.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -74.99 145.54 31.62 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 C-N-CA 122.427 2.085 . . . . 0.0 112.333 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER -122.87 130.73 53.23 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.866 0.841 . . . . 0.0 109.575 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.9 p -141.07 167.42 22.24 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.713 0.768 . . . . 0.0 109.568 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.504 ' O ' ' N ' ' A' ' 47' ' ' GLU . 55.3 t80 -123.88 126.84 25.59 Favored Pre-proline 0 N--CA 1.488 1.448 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -46.28 83.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 122.446 2.097 . . . . 0.0 112.251 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 45' ' ' TYR . 45.2 tp10 -170.79 147.6 2.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 109.374 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -109.88 127.52 54.77 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.607 0.718 . . . . 0.0 109.686 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.05 133.5 54.32 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.979 0.895 . . . . 0.0 109.778 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -87.09 -24.31 24.61 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -103.72 132.53 49.89 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.974 0.892 . . . . 0.0 109.732 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.654 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 1.1 pm0 -68.83 -34.86 76.19 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.39 -47.68 72.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.667 -0.646 . . . . 0.0 109.323 -179.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.412 ' O ' HG23 ' A' ' 58' ' ' VAL . 54.4 m-20 -65.21 -37.58 87.73 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.575 -0.703 . . . . 0.0 109.371 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -36.45 82.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.735 -0.603 . . . . 0.0 109.566 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.61 -51.42 67.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.708 -0.62 . . . . 0.0 109.616 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -63.66 -43.47 96.63 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.393 0.616 . . . . 0.0 109.53 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 54' ' ' ASP . 72.5 t -64.96 -39.61 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.3 m -55.89 -43.14 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.578 -0.701 . . . . 0.0 109.519 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.18 -45.88 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.602 -0.686 . . . . 0.0 109.593 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.87 -36.82 80.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.545 -0.722 . . . . 0.0 109.293 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -65.8 -49.44 68.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.647 -0.658 . . . . 0.0 109.732 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.44 -39.77 64.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.736 -0.602 . . . . 0.0 109.661 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -39.82 94.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.71 -0.619 . . . . 0.0 109.688 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.68 -43.97 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.67 -0.644 . . . . 0.0 109.855 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.36 -43.54 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.528 -0.732 . . . . 0.0 109.462 -179.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.2 mt -63.7 -44.71 98.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.434 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 97.2 m-20 -69.99 -44.77 68.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.429 0.633 . . . . 0.0 109.77 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.1 t -65.7 -42.02 91.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.666 -0.646 . . . . 0.0 109.781 -179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -59.24 -44.75 92.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.641 -0.662 . . . . 0.0 109.468 -179.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.2 -43.08 96.15 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.645 -0.66 . . . . 0.0 110.025 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.497 -0.752 . . . . 0.0 109.062 179.957 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.521 0 N-CA-C 108.934 -1.667 . . . . 0.0 108.934 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.5 mt -100.35 21.34 13.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.581 -0.952 . . . . 0.0 108.456 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.34 98.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.931 -0.48 . . . . 0.0 109.944 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.86 -35.83 81.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.682 -0.636 . . . . 0.0 109.547 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.2 mt -85.1 -6.26 59.31 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 109.5 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.675 0 CA-C-O 117.952 -1.471 . . . . 0.0 109.729 -179.774 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 121.301 0.572 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.86 133.28 53.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.563 -0.711 . . . . 0.0 109.525 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -83.34 135.17 34.82 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.413 -0.804 . . . . 0.0 109.971 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -144.0 117.86 9.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.347 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.449 ' HE ' ' CD1' ' A' ' 71' ' ' LEU . 78.5 mtp85 53.85 29.15 9.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.551 -0.718 . . . . 0.0 109.758 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.09 -4.56 83.04 Favored Glycine 0 N--CA 1.494 2.531 0 N-CA-C 110.199 -1.161 . . . . 0.0 110.199 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -105.89 134.44 49.02 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.456 -1.026 . . . . 0.0 109.935 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.89 144.6 25.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 109.091 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 78.8 mt -120.19 136.45 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.249 0.547 . . . . 0.0 109.628 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -121.56 85.61 43.71 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -61.48 150.22 86.17 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.858 2.372 . . . . 0.0 112.536 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.566 ' O ' ' CG ' ' A' ' 15' ' ' HIS . . . -174.01 -9.1 0.02 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.566 ' CG ' ' O ' ' A' ' 14' ' ' GLY . 3.9 p-80 56.57 153.34 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.785 -0.832 . . . . 0.0 110.571 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -169.24 153.11 5.23 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.494 -0.754 . . . . 0.0 109.059 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -98.99 137.49 37.45 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.537 -0.727 . . . . 0.0 109.649 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -92.19 135.95 33.58 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.582 -0.699 . . . . 0.0 109.593 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.47 -19.95 63.75 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.51 -0.744 . . . . 0.0 109.504 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -62.95 -44.65 95.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.477 -0.765 . . . . 0.0 109.88 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.2 pt -109.71 2.76 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.666 -0.646 . . . . 0.0 109.289 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 43.44 43.05 4.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.626 -0.672 . . . . 0.0 109.438 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.8 tptm -139.39 164.46 29.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.409 -0.807 . . . . 0.0 109.732 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -85.1 129.97 34.7 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.734 -0.604 . . . . 0.0 109.765 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' H ' ' A' ' 48' ' ' PHE . 0.5 OUTLIER -150.17 155.17 37.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.378 -0.826 . . . . 0.0 108.998 179.512 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -43.47 135.83 6.41 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.198 1.932 . . . . 0.0 112.693 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE2' ' CB ' ' A' ' 42' ' ' PRO . 48.7 t80 -153.5 114.47 4.1 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.39 152.35 49.55 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.388 -0.82 . . . . 0.0 109.706 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.05 129.62 44.89 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.4 mt -115.83 131.41 68.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.627 -0.671 . . . . 0.0 110.035 -179.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -132.9 145.74 51.19 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.586 -0.696 . . . . 0.0 109.21 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -82.62 128.23 34.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.211 -0.93 . . . . 0.0 109.797 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.4 t . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.566 -0.709 . . . . 0.0 110.165 -179.684 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.541 ' O ' HD21 ' A' ' 81' ' ' LEU . 45.9 m . . . . . 0 N--CA 1.496 1.85 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -75.45 146.86 31.58 Favored 'Trans proline' 0 N--CA 1.493 1.499 0 C-N-CA 122.197 1.932 . . . . 0.0 113.024 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.407 HD12 ' O ' ' A' ' 39' ' ' THR . 4.5 mp -134.35 90.69 24.21 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.479 ' CB ' ' CE2' ' A' ' 27' ' ' TYR . 48.3 Cg_exo -54.72 144.75 63.7 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.319 2.013 . . . . 0.0 111.87 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 t -99.67 136.14 40.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.581 -0.699 . . . . 0.0 109.227 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -136.56 157.52 46.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -139.31 101.35 7.54 Favored Pre-proline 0 N--CA 1.492 1.64 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.2 107.14 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 121.825 1.683 . . . . 0.0 112.475 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 48' ' ' PHE . 54.6 mt-10 -150.66 -13.13 0.24 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.482 ' H ' HG12 ' A' ' 25' ' ' VAL . 1.6 m-85 54.24 108.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.238 0.542 . . . . 0.0 110.1 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -131.54 132.86 44.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.582 -0.699 . . . . 0.0 109.417 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -87.24 -22.11 25.41 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.736 . . . . 0.0 109.316 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -91.12 133.08 35.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.466 -0.771 . . . . 0.0 110.659 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -67.62 -38.02 83.33 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.55 -40.45 91.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 109.759 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 58' ' ' VAL . 99.5 m-20 -62.75 -43.3 99.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.433 -0.792 . . . . 0.0 109.817 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.48 96.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.453 -0.78 . . . . 0.0 110.034 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -66.91 -49.44 65.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.401 -0.812 . . . . 0.0 109.911 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -65.99 -43.65 87.18 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.514 -0.741 . . . . 0.0 109.653 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 54' ' ' ASP . 67.6 t -65.11 -42.65 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.603 -0.686 . . . . 0.0 109.532 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -58.09 -42.23 85.18 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.458 -0.777 . . . . 0.0 109.87 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.421 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.4 mt -64.81 -44.85 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.139 -0.975 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.06 -44.36 80.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.502 -0.749 . . . . 0.0 109.485 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.1 m -65.86 -43.62 87.83 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.583 -0.698 . . . . 0.0 109.265 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -50.17 -42.91 51.96 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.421 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 64.2 mttp -63.31 -43.01 99.03 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.489 -0.757 . . . . 0.0 109.302 179.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.12 -44.75 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.375 -0.828 . . . . 0.0 109.774 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -66.04 -45.93 89.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.376 -0.828 . . . . 0.0 109.138 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.8 mt -64.75 -44.65 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.485 -0.759 . . . . 0.0 109.629 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -68.52 -46.35 69.8 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.538 -0.727 . . . . 0.0 109.87 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.6 m -62.63 -42.15 99.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.568 -0.708 . . . . 0.0 110.094 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -59.16 -42.34 90.51 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.754 . . . . 0.0 109.674 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.449 ' CD1' ' HE ' ' A' ' 7' ' ' ARG . 81.9 mt -64.88 -36.0 82.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.588 -0.695 . . . . 0.0 109.719 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.854 . . . . 0.0 109.626 -179.534 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.6 mt -101.91 17.87 22.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.536 -0.979 . . . . 0.0 109.521 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.93 -38.68 89.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.393 -0.817 . . . . 0.0 109.48 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.85 -37.28 86.79 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.524 -0.735 . . . . 0.0 109.835 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.541 HD21 ' O ' ' A' ' 39' ' ' THR . 54.2 mt -83.38 -3.14 57.24 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.354 -0.841 . . . . 0.0 109.121 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.82 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.3 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -76.67 151.94 35.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.486 -0.759 . . . . 0.0 110.13 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m -72.37 140.62 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.604 -0.685 . . . . 0.0 109.887 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.76 140.62 32.68 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.267 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -83.19 149.85 26.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.329 -0.857 . . . . 0.0 110.267 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.406 ' N ' ' O ' ' A' ' 9' ' ' TYR . 88.1 t80 -153.54 115.04 4.2 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.409 -0.807 . . . . 0.0 109.327 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.488 HH12 ' CD1' ' A' ' 71' ' ' LEU . 20.7 mtp-105 52.07 30.18 7.22 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.414 -0.804 . . . . 0.0 109.921 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.68 -1.87 81.82 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.406 ' O ' ' N ' ' A' ' 6' ' ' TYR . 95.4 m-85 -106.73 141.93 37.19 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.373 -1.075 . . . . 0.0 109.761 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -89.72 146.1 24.74 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.524 -0.735 . . . . 0.0 109.491 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -121.59 136.52 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' ' H ' ' A' ' 29' ' ' LEU . 21.7 tt0 -119.18 87.68 35.46 Favored Pre-proline 0 N--CA 1.496 1.857 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.11 146.05 95.68 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.524 2.149 . . . . 0.0 112.204 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 176.54 -167.72 39.37 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -148.48 142.9 26.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.283 -1.127 . . . . 0.0 109.535 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -161.85 150.57 15.48 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -109.09 143.5 38.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.476 -0.765 . . . . 0.0 109.66 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.438 ' NH2' HG21 ' A' ' 44' ' ' THR . 86.2 mtt180 -99.47 139.11 35.61 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 121.529 0.68 . . . . 0.0 109.83 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.26 -20.24 64.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.442 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.92 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.154 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.5 pt -109.63 0.02 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 42.12 39.64 1.44 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.785 -0.572 . . . . 0.0 109.868 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -140.5 161.45 37.7 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.285 -0.885 . . . . 0.0 109.825 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -85.73 130.86 34.45 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 121.429 0.633 . . . . 0.0 109.854 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.2 m -144.98 146.85 32.58 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.45 -0.781 . . . . 0.0 109.338 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -37.72 111.55 0.1 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 122.571 2.181 . . . . 0.0 112.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -121.57 117.33 26.5 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -142.15 159.0 43.11 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.193 -0.942 . . . . 0.0 109.592 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.431 ' H ' ' HB3' ' A' ' 12' ' ' GLU . 53.8 mt -113.6 134.47 54.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.638 -0.664 . . . . 0.0 109.238 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.9 mt -111.92 133.1 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.681 -0.637 . . . . 0.0 109.53 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -127.32 130.63 49.84 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -83.4 138.64 33.41 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.646 0.736 . . . . 0.0 110.326 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 92.5 t -64.44 -42.51 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.718 -0.614 . . . . 0.0 109.939 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.82 -36.39 93.24 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.195 -1.002 . . . . 0.0 110.635 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.1 m -150.54 73.17 9.0 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 120.855 -1.379 . . . . 0.0 109.795 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -77.47 -9.61 17.4 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.405 2.07 . . . . 0.0 111.125 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -76.0 -6.29 50.3 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.578 -0.701 . . . . 0.0 109.128 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -78.68 147.46 33.5 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.394 -0.817 . . . . 0.0 109.965 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.8 m -44.9 131.15 5.27 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -74.25 151.92 44.11 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.887 1.725 . . . . 0.0 111.882 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.489 HD11 ' OD2' ' A' ' 80' ' ' ASP . 38.6 mm -115.48 100.21 53.33 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.57 136.2 41.13 Favored 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 121.897 1.731 . . . . 0.0 112.483 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 p -95.27 134.97 37.45 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.438 HG21 ' NH2' ' A' ' 18' ' ' ARG . 54.7 p -138.01 167.16 22.36 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -148.89 141.68 15.42 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.178 -0.951 . . . . 0.0 108.929 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.56 86.33 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.88 1.72 . . . . 0.0 112.226 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -176.4 169.5 2.66 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.499 -0.751 . . . . 0.0 108.98 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -130.7 146.91 52.3 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.418 -0.801 . . . . 0.0 109.413 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.505 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 27.9 m-85 -141.81 123.46 15.1 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.356 -0.84 . . . . 0.0 109.589 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.16 -33.25 67.57 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.355 0.598 . . . . 0.0 109.701 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -89.45 133.12 34.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.805 . . . . 0.0 110.538 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -69.57 -36.04 75.91 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.452 0.644 . . . . 0.0 109.476 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.58 91.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.506 -0.746 . . . . 0.0 109.515 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.505 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 58.0 t0 -63.09 -38.01 89.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.378 -0.826 . . . . 0.0 109.051 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.41 -36.64 84.81 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.493 -0.754 . . . . 0.0 109.639 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.53 -49.48 75.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 109.731 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.63 -42.77 95.27 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.272 -0.892 . . . . 0.0 109.444 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.5 t -65.22 -42.78 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.564 -0.71 . . . . 0.0 109.631 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 98.1 p -56.62 -39.39 73.55 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.411 -0.805 . . . . 0.0 109.676 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.84 -45.29 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 109.296 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.71 82.11 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.339 -0.851 . . . . 0.0 109.423 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.56 -46.15 76.99 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.468 -0.77 . . . . 0.0 109.5 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.13 73.99 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.369 -0.832 . . . . 0.0 109.452 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.42 -43.96 95.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.301 -0.874 . . . . 0.0 109.365 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.37 -44.38 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.433 -0.792 . . . . 0.0 110.104 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 32.7 mm -64.17 -44.38 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.157 -0.964 . . . . 0.0 109.404 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 94.7 mt -64.38 -45.66 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.159 -0.963 . . . . 0.0 109.506 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.28 -46.36 77.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.338 -0.852 . . . . 0.0 109.635 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.486 ' O ' ' N ' ' A' ' 73' ' ' ARG . 19.2 m -63.15 -37.91 89.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.546 -0.721 . . . . 0.0 109.85 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -59.78 -47.9 83.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.631 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.488 ' CD1' HH12 ' A' ' 7' ' ' ARG . 90.6 mt -64.18 -42.8 96.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.348 -0.845 . . . . 0.0 109.871 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -83.37 -67.59 0.78 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.319 -0.863 . . . . 0.0 110.33 -179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.486 ' N ' ' O ' ' A' ' 69' ' ' SER . 80.7 mtp85 -84.43 142.91 29.77 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.383 -0.823 . . . . 0.0 110.213 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -85.75 66.88 9.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.563 -0.71 . . . . 0.0 109.087 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -79.58 -3.11 45.51 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? 54.31 93.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.548 0.69 . . . . 0.0 109.892 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -152.87 -65.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.058 -1.617 . . . . 0.0 109.058 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.18 30.55 1.23 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.275 -1.133 . . . . 0.0 109.305 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.15 -35.81 81.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.648 -0.658 . . . . 0.0 109.308 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.489 ' OD2' HD11 ' A' ' 41' ' ' ILE . 23.1 p-10 -64.69 -31.88 73.3 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.481 -0.762 . . . . 0.0 109.625 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.35 -3.29 57.36 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.326 -0.859 . . . . 0.0 109.471 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.349 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.68 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.467 0.651 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -88.14 110.71 20.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.378 -0.827 . . . . 0.0 109.607 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.2 m -84.75 150.83 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 109.98 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.28 140.82 47.67 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.575 -0.703 . . . . 0.0 109.433 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.9 m170 -85.13 154.13 22.23 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.401 -0.812 . . . . 0.0 110.307 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.615 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 20.6 t80 -153.3 111.43 3.62 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.328 -0.857 . . . . 0.0 109.044 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.615 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 47.41 31.86 2.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.539 -0.726 . . . . 0.0 110.102 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.34 -20.74 47.98 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -85.4 138.42 32.27 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -1.067 . . . . 0.0 110.107 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.31 139.13 31.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.626 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.0 mt -121.29 130.42 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -121.93 87.94 47.31 Favored Pre-proline 0 N--CA 1.496 1.837 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -57.82 144.97 92.56 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 122.697 2.264 . . . . 0.0 112.506 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.91 98.19 0.11 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -49.01 155.82 0.58 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.434 -1.039 . . . . 0.0 110.793 -179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -154.87 157.87 38.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.39 -0.819 . . . . 0.0 109.051 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -99.96 120.66 40.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.593 -0.692 . . . . 0.0 109.396 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.483 ' NH1' ' OG1' ' A' ' 44' ' ' THR . 84.4 mtp180 -102.04 138.58 38.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.601 -0.687 . . . . 0.0 109.964 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.22 -17.03 58.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.554 -0.716 . . . . 0.0 109.404 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -59.64 -49.54 77.35 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.222 -0.924 . . . . 0.0 109.652 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.444 HG13 ' H ' ' A' ' 23' ' ' LYS . 41.1 pt -107.9 0.27 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 50.33 34.93 9.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.643 -0.661 . . . . 0.0 109.582 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.444 ' H ' HG13 ' A' ' 21' ' ' ILE . 56.0 mmtt -140.44 174.42 10.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.366 -0.834 . . . . 0.0 110.217 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -93.72 130.29 39.74 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.534 0.683 . . . . 0.0 109.954 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.472 ' CG1' ' O ' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -143.17 155.63 61.68 Favored Pre-proline 0 N--CA 1.492 1.632 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -55.37 110.19 0.52 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.211 1.941 . . . . 0.0 111.85 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -114.68 117.54 31.12 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -132.52 147.94 52.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.581 -0.699 . . . . 0.0 109.534 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -93.3 128.33 39.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.539 -0.726 . . . . 0.0 109.474 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.3 mt -110.01 127.5 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -132.0 133.27 44.26 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.582 -0.699 . . . . 0.0 109.395 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.42 125.6 40.15 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.661 0.744 . . . . 0.0 109.562 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 98.7 t -60.19 136.9 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.533 0.682 . . . . 0.0 110.694 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.47 -13.25 61.41 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.46 HG12 HH12 ' A' ' 38' ' ' ARG . 3.8 m -152.48 77.53 6.57 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.159 -1.201 . . . . 0.0 109.77 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -76.25 -9.49 19.04 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 122.476 2.117 . . . . 0.0 111.07 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.592 ' C ' ' H ' ' A' ' 39' ' ' THR . 71.0 m-20 -86.7 -145.49 0.12 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.63 -0.669 . . . . 0.0 109.957 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.46 HH12 HG12 ' A' ' 35' ' ' VAL . 84.9 mtt85 57.8 -0.84 0.09 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.442 0.639 . . . . 0.0 110.079 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.592 ' H ' ' C ' ' A' ' 37' ' ' ASP . 2.7 m 74.18 132.3 0.04 OUTLIER Pre-proline 0 C--N 1.296 -1.73 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.168 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.34 153.95 70.11 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.006 1.804 . . . . 0.0 112.272 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.6 mm -122.34 88.87 49.07 Favored Pre-proline 0 N--CA 1.494 1.732 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -55.25 146.6 59.81 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.662 2.241 . . . . 0.0 112.539 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.78 135.79 40.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.569 -0.707 . . . . 0.0 109.587 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.483 ' OG1' ' NH1' ' A' ' 18' ' ' ARG . 32.0 p -136.21 167.93 20.36 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -136.2 136.62 22.94 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.99 86.82 1.06 Allowed 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 121.974 1.783 . . . . 0.0 112.119 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.472 ' O ' ' CG1' ' A' ' 25' ' ' VAL . 8.9 tt0 -168.54 -173.35 1.9 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 109.213 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -133.69 121.17 21.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.609 -0.682 . . . . 0.0 109.26 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.508 ' C ' ' H ' ' A' ' 51' ' ' LEU . 91.8 m-85 -111.79 -36.88 5.31 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 42.9 t0 58.87 -0.3 0.14 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.775 -0.578 . . . . 0.0 109.925 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.8 mt -118.03 126.67 52.75 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.397 -0.815 . . . . 0.0 109.638 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.95 -42.49 80.85 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.591 -0.693 . . . . 0.0 109.641 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.66 -47.93 83.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 109.621 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 58' ' ' VAL . 38.7 t0 -67.0 -38.76 86.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.75 -40.98 98.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.304 -0.873 . . . . 0.0 109.216 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -67.87 -44.99 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.874 . . . . 0.0 109.649 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -65.63 -44.57 86.05 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.282 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 54' ' ' ASP . 72.0 t -67.87 -41.4 84.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.572 -0.705 . . . . 0.0 109.418 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.4 p -56.63 -41.32 76.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.207 -0.933 . . . . 0.0 109.616 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.34 -45.0 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.055 -1.028 . . . . 0.0 109.509 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.69 -46.04 73.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.375 -0.828 . . . . 0.0 109.96 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.5 m -66.24 -49.58 66.72 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.423 -0.798 . . . . 0.0 109.495 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -45.4 -46.14 13.1 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.679 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.59 -41.87 98.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.02 -43.93 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.152 -0.968 . . . . 0.0 109.466 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.64 -44.81 96.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.216 -0.928 . . . . 0.0 108.621 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.07 -43.94 97.62 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 O-C-N 121.06 -1.025 . . . . 0.0 108.795 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.93 -41.82 97.53 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.317 -0.864 . . . . 0.0 109.19 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -60.91 -40.91 94.89 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.525 -0.734 . . . . 0.0 109.35 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -58.92 -44.84 91.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.194 -0.941 . . . . 0.0 109.157 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.14 -41.12 97.31 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.494 -0.754 . . . . 0.0 109.045 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -69.58 -68.33 0.42 Allowed 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.405 -0.809 . . . . 0.0 109.432 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -155.42 -80.9 0.08 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 109.273 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 61.78 158.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.67 0.748 . . . . 0.0 110.635 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -77.83 -85.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.584 -0.698 . . . . 0.0 109.723 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -139.71 77.41 1.61 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.572 -0.705 . . . . 0.0 109.16 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -98.16 -95.21 1.98 Allowed Glycine 0 N--CA 1.495 2.61 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -85.26 33.05 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -1.151 . . . . 0.0 108.414 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.12 89.9 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.624 -0.672 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.9 -45.57 91.92 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.366 -0.834 . . . . 0.0 109.618 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.54 -41.39 93.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.337 -0.852 . . . . 0.0 109.773 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.021 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 -179.486 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.0 mpp? . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.213 0.53 . . . . 0.0 109.786 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -81.29 162.16 23.59 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.353 -0.842 . . . . 0.0 110.51 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.9 m -85.02 156.5 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.429 -0.794 . . . . 0.0 109.978 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.61 138.84 51.12 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.72 -0.612 . . . . 0.0 109.594 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 m170 -99.6 114.81 28.07 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.393 -0.817 . . . . 0.0 109.531 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -86.72 -75.62 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.432 -0.792 . . . . 0.0 109.66 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -127.2 52.14 1.83 Allowed 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 93.96 -0.41 66.92 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -112.39 140.32 47.22 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.385 -1.068 . . . . 0.0 109.993 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -84.21 145.13 28.51 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -120.94 130.2 74.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -127.3 97.75 30.88 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.93 153.79 37.73 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.422 2.082 . . . . 0.0 113.201 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.71 -150.14 8.09 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.52 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 52.7 p-80 -152.67 147.53 26.22 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -1.111 . . . . 0.0 109.428 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.427 ' OE1' ' CZ ' ' A' ' 27' ' ' TYR . 58.4 tt0 -169.05 157.67 8.01 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.392 -0.818 . . . . 0.0 109.02 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -110.04 145.77 36.47 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.464 0.65 . . . . 0.0 110.002 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.559 HH21 ' CG2' ' A' ' 44' ' ' THR . 35.2 mmt180 -96.32 125.24 40.69 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.658 0.742 . . . . 0.0 109.728 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 38.5 p-10 -70.22 -21.5 63.01 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.715 -0.615 . . . . 0.0 109.959 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -62.33 -42.58 99.49 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.764 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.6 pt -116.7 -6.8 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 18' ' ' ARG . 28.0 mmt180 55.82 57.55 5.11 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.4 0.619 . . . . 0.0 110.034 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -144.09 160.17 41.36 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 0.0 109.788 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -90.23 129.28 36.5 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.628 -0.67 . . . . 0.0 109.375 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 11.8 m -141.93 148.97 51.15 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.447 -0.783 . . . . 0.0 109.544 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -41.48 110.1 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.294 0 C-N-CA 122.307 2.004 . . . . 0.0 111.536 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.427 ' CZ ' ' OE1' ' A' ' 16' ' ' GLN . 56.2 t80 -103.66 116.74 32.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.804 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -139.77 144.29 37.35 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.1 mt -109.96 130.45 55.53 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.8 mt -112.71 131.04 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -129.04 132.3 47.46 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -83.89 138.78 33.01 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.427 -0.796 . . . . 0.0 109.619 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.7 t -67.55 133.98 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.407 -0.808 . . . . 0.0 110.36 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.72 -15.83 56.72 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.436 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 23.8 m -153.53 54.69 1.19 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.287 -1.125 . . . . 0.0 109.637 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 29.7 Cg_endo -66.83 -17.64 52.15 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.581 2.187 . . . . 0.0 111.568 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -67.89 -135.28 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.463 -0.773 . . . . 0.0 110.359 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 52.64 176.33 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.775 0.797 . . . . 0.0 111.049 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 35.3 m -73.18 131.74 83.0 Favored Pre-proline 0 C--N 1.306 -1.294 0 O-C-N 121.486 -0.759 . . . . 0.0 110.003 -178.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.28 140.75 45.28 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.141 1.894 . . . . 0.0 112.582 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.93 103.27 54.85 Favored Pre-proline 0 N--CA 1.494 1.735 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.18 145.1 38.51 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.095 1.863 . . . . 0.0 112.061 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.804 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -108.64 137.49 46.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.548 -0.72 . . . . 0.0 109.457 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.559 ' CG2' HH21 ' A' ' 18' ' ' ARG . 45.8 p -138.09 167.85 20.95 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -130.99 140.39 38.53 Favored Pre-proline 0 N--CA 1.491 1.589 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -43.33 -28.25 1.49 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 122.207 1.938 . . . . 0.0 112.089 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.51 158.79 26.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.317 -0.864 . . . . 0.0 110.158 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -126.8 147.75 49.99 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.637 -0.665 . . . . 0.0 109.389 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.516 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 78.9 m-85 -152.44 114.52 4.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.326 -0.859 . . . . 0.0 109.801 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -71.13 -33.49 70.15 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.529 -0.732 . . . . 0.0 109.207 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -69.74 135.34 49.65 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.528 -0.733 . . . . 0.0 110.332 -178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.52 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 85.1 tt0 -71.74 -41.05 68.96 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.503 -0.748 . . . . 0.0 109.731 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.21 -45.94 86.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.302 -0.874 . . . . 0.0 109.738 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.516 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.0 t0 -63.99 -38.58 91.6 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.346 -0.846 . . . . 0.0 109.546 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.64 91.83 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.343 -0.848 . . . . 0.0 109.47 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.81 -46.39 82.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.345 -0.847 . . . . 0.0 109.724 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -64.21 -44.38 92.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.325 -0.859 . . . . 0.0 109.621 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.3 t -67.32 -42.03 87.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.393 -0.817 . . . . 0.0 109.761 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.558 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 78.5 p -56.49 -40.75 75.47 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.27 -0.894 . . . . 0.0 109.688 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.441 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 96.6 mt -64.13 -45.66 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 120.983 -1.073 . . . . 0.0 109.155 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.09 -38.8 86.34 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.6 t -64.95 -50.55 65.98 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.537 -0.727 . . . . 0.0 109.437 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.66 -41.71 43.44 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.62 -0.675 . . . . 0.0 109.634 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.441 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 63.2 mttp -62.9 -41.35 99.41 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.293 -0.879 . . . . 0.0 109.337 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 95.5 mt -64.1 -43.84 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.839 . . . . 0.0 109.805 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 66' ' ' ILE . 2.0 mp -65.54 -45.33 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.364 -0.835 . . . . 0.0 109.129 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.62 -44.84 96.71 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.163 -0.961 . . . . 0.0 109.371 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -67.59 -43.78 79.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.333 -0.854 . . . . 0.0 109.719 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.402 ' HG ' ' HA ' ' A' ' 66' ' ' ILE . 78.0 p -67.04 -35.59 80.21 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.385 -0.822 . . . . 0.0 109.067 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.38 -43.99 92.81 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.285 -0.884 . . . . 0.0 109.394 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.9 mt -63.75 -40.99 98.06 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.377 -0.827 . . . . 0.0 109.218 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.438 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 57.3 t0 -68.96 -2.18 9.2 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.351 -0.843 . . . . 0.0 109.198 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 67.74 68.0 0.36 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.807 -0.558 . . . . 0.0 110.257 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -122.92 113.72 19.48 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.525 0.679 . . . . 0.0 109.236 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' GLN . 96.8 m-20 51.81 178.09 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.667 0.746 . . . . 0.0 110.965 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.425 ' O ' ' O ' ' A' ' 75' ' ' ASP . 85.9 mt-30 -48.16 -100.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.441 0.639 . . . . 0.0 110.348 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 79' ' ' ALA . . . 61.87 125.12 0.01 OUTLIER Glycine 0 N--CA 1.489 2.223 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.409 ' C ' ' O ' ' A' ' 77' ' ' GLY . 9.1 mt 41.68 22.99 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.52 -0.988 . . . . 0.0 109.586 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' A' ' 77' ' ' GLY . . . -60.21 -47.71 84.81 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.55 -0.719 . . . . 0.0 109.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -65.68 -36.54 83.93 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.339 -0.85 . . . . 0.0 109.451 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.9 mt -84.09 -3.19 57.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.388 -0.82 . . . . 0.0 109.255 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 179.984 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mtp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.294 0.569 . . . . 0.0 109.878 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -77.29 154.44 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.459 -0.775 . . . . 0.0 110.179 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.5 138.72 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.502 -0.749 . . . . 0.0 110.014 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -89.36 159.99 17.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.453 -0.779 . . . . 0.0 109.815 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.91 139.88 47.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.553 -0.717 . . . . 0.0 109.392 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -151.05 119.98 6.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.189 -0.945 . . . . 0.0 109.496 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 54.28 28.04 8.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.648 -0.658 . . . . 0.0 110.199 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.62 0.21 86.34 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -104.35 139.99 38.53 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.578 -0.954 . . . . 0.0 109.504 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -89.2 140.74 29.16 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.406 -0.809 . . . . 0.0 109.144 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -119.83 130.13 74.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -117.11 121.04 32.96 Favored Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.02 157.68 46.6 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.059 1.839 . . . . 0.0 112.565 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.05 -172.27 44.3 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.0 p-80 -150.7 146.06 26.21 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.339 -1.095 . . . . 0.0 109.073 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.51 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 53.8 tt0 -168.47 155.62 7.66 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.276 -0.89 . . . . 0.0 109.002 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -104.91 139.9 38.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.494 -0.754 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.2 mtp180 -90.97 134.43 34.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.559 -0.713 . . . . 0.0 109.566 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 39.0 p-10 -68.29 -21.49 64.78 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.368 -0.833 . . . . 0.0 109.247 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -60.9 -47.68 85.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.554 -0.716 . . . . 0.0 109.867 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 18.6 pt -107.39 -2.5 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.473 -0.767 . . . . 0.0 108.99 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 49.21 46.64 22.77 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.504 -0.747 . . . . 0.0 110.051 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.25 165.9 26.56 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -0.821 . . . . 0.0 109.598 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -85.04 132.78 34.28 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.541 -0.725 . . . . 0.0 109.766 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -148.77 156.03 41.26 Favored Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.285 -0.884 . . . . 0.0 108.794 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -43.85 128.94 7.26 Favored 'Trans proline' 0 C--N 1.314 -1.273 0 C-N-CA 122.11 1.873 . . . . 0.0 112.067 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.51 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 66.0 t80 -131.85 120.38 22.5 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 59' ' ' SER . . . -144.53 151.71 39.51 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.168 -0.958 . . . . 0.0 108.789 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.2 mt -106.11 129.93 54.1 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.6 mt -110.68 130.44 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.638 -0.664 . . . . 0.0 109.32 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -131.24 126.66 36.06 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -81.49 139.24 35.28 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.339 -0.851 . . . . 0.0 109.741 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 69.9 t -65.62 134.83 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 110.246 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.61 -22.04 37.0 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.7 m -152.46 65.06 5.8 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.154 -1.203 . . . . 0.0 110.158 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.41 -37.01 97.89 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 122.239 1.96 . . . . 0.0 110.918 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -65.01 -125.54 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.074 0.464 . . . . 0.0 110.474 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.426 ' O ' ' O ' ' A' ' 39' ' ' THR . 83.6 mmt-85 52.83 28.62 6.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.488 -0.758 . . . . 0.0 109.339 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.426 ' O ' ' O ' ' A' ' 38' ' ' ARG . 27.5 m 60.72 130.59 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.382 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -73.01 152.58 51.63 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 122.339 2.026 . . . . 0.0 112.512 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.6 mm -129.0 89.3 49.1 Favored Pre-proline 0 N--CA 1.499 1.987 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -56.1 145.75 73.87 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.317 2.011 . . . . 0.0 111.547 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -117.1 135.4 53.77 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.556 0.693 . . . . 0.0 109.821 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.0 p -138.03 166.2 24.68 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -133.01 133.89 23.74 Favored Pre-proline 0 N--CA 1.495 1.798 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.82 85.14 1.36 Allowed 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 121.957 1.772 . . . . 0.0 112.329 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.443 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 80.7 tt0 -138.62 -16.18 1.17 Allowed 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 47' ' ' GLU . 9.6 m-85 58.39 119.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.131 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.533 ' CE1' ' OD2' ' A' ' 54' ' ' ASP . 12.4 m-85 -131.37 133.97 45.82 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.736 0.779 . . . . 0.0 109.419 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -85.06 -24.76 27.99 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.706 -0.621 . . . . 0.0 109.456 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.4 mm? -96.91 126.17 41.87 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-O 122.079 0.943 . . . . 0.0 109.854 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -67.76 -33.36 74.68 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.53 -47.32 86.67 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.609 -0.682 . . . . 0.0 110.016 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD2' ' CE1' ' A' ' 49' ' ' TYR . 14.9 t70 -64.35 -34.39 78.04 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.513 -0.742 . . . . 0.0 109.342 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.2 -42.3 90.58 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.564 -0.71 . . . . 0.0 109.538 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -64.13 -49.3 72.72 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.449 -0.782 . . . . 0.0 109.845 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' A' ' 57' ' ' ARG . 0.6 OUTLIER -63.59 -43.93 95.5 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.488 -0.758 . . . . 0.0 109.418 -179.516 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.3 t -64.17 -42.27 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.374 -0.829 . . . . 0.0 109.286 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.539 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 31.2 m -52.39 -42.95 64.44 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.272 -0.892 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.1 mt -64.02 -44.77 97.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.279 -0.888 . . . . 0.0 109.265 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.89 71.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.438 -0.789 . . . . 0.0 109.698 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.93 -43.29 99.16 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.484 -0.76 . . . . 0.0 109.147 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.34 -42.44 41.74 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.403 -0.811 . . . . 0.0 109.285 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -62.58 -43.67 98.23 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.38 -0.825 . . . . 0.0 109.251 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -65.82 -45.19 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.502 -0.749 . . . . 0.0 109.791 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.3 -44.47 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 O-C-N 121.212 -0.93 . . . . 0.0 109.165 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.03 -45.02 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.134 -0.979 . . . . 0.0 109.112 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -65.13 -44.26 89.23 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.468 -0.77 . . . . 0.0 109.606 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.558 ' O ' ' N ' ' A' ' 73' ' ' ARG . 39.4 m -63.76 -36.64 84.55 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.583 -0.698 . . . . 0.0 109.641 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 13.6 t60 -57.8 -50.62 72.66 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.1 mt -66.5 -42.01 88.03 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.48 -0.762 . . . . 0.0 110.171 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' O ' ' O ' ' A' ' 73' ' ' ARG . 91.7 m-20 -90.6 -67.3 0.86 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.36 -0.838 . . . . 0.0 110.279 -179.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.558 ' N ' ' O ' ' A' ' 69' ' ' SER . 33.9 ttm-85 -58.76 -141.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.653 0.739 . . . . 0.0 110.781 -178.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -67.14 144.17 56.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.597 -0.689 . . . . 0.0 110.311 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.405 ' N ' ' OD1' ' A' ' 75' ' ' ASP . 35.1 p-10 -92.68 4.71 53.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.491 -0.755 . . . . 0.0 109.131 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.89 -39.99 94.39 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.421 -0.799 . . . . 0.0 109.611 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.451 ' O ' ' ND1' ' A' ' 70' ' ' HIS . . . -69.0 142.93 38.78 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.4 mt 55.1 20.44 3.31 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.491 -1.005 . . . . 0.0 109.388 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.92 89.17 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.416 -0.802 . . . . 0.0 109.677 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -63.01 -37.45 87.25 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.362 -0.836 . . . . 0.0 109.475 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 44.1 mt -82.48 -3.8 56.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.383 -0.823 . . . . 0.0 109.428 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.287 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.514 0.674 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -90.05 -72.19 0.58 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.482 -0.761 . . . . 0.0 109.7 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.481 ' CG1' ' OE1' ' A' ' 12' ' ' GLU . 15.3 m -78.16 149.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 0.0 110.435 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.73 153.02 19.18 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.501 -0.749 . . . . 0.0 109.622 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -103.65 128.65 50.93 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.574 -0.704 . . . . 0.0 109.771 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -143.03 121.89 12.7 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.403 -0.811 . . . . 0.0 109.574 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 54.14 24.73 5.06 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.534 0.683 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.62 4.09 80.16 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -109.53 139.5 44.46 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.532 -0.981 . . . . 0.0 109.975 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -87.28 144.93 26.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.391 -0.818 . . . . 0.0 109.577 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -123.47 131.79 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.667 -0.645 . . . . 0.0 109.417 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.481 ' OE1' ' CG1' ' A' ' 3' ' ' VAL . 8.8 tp10 -116.0 117.63 39.19 Favored Pre-proline 0 N--CA 1.493 1.712 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -77.19 155.0 32.96 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.187 1.925 . . . . 0.0 112.845 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.99 -163.76 36.2 Favored Glycine 0 N--CA 1.486 1.991 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -151.27 146.46 26.06 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.026 -1.279 . . . . 0.0 109.346 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.48 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 49.2 tt0 -166.23 155.31 11.34 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.165 -0.959 . . . . 0.0 109.755 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -107.24 135.51 48.64 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.316 0.579 . . . . 0.0 109.849 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.491 ' O ' ' N ' ' A' ' 22' ' ' ARG . 79.9 mtp85 -96.08 137.97 34.38 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.83 0.824 . . . . 0.0 109.981 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -67.31 -21.98 65.65 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.524 0.678 . . . . 0.0 109.306 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.61 -44.52 96.1 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.449 -0.782 . . . . 0.0 109.906 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.1 pt -114.68 0.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.491 ' N ' ' O ' ' A' ' 18' ' ' ARG . 84.5 mtt85 43.56 41.08 3.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.546 -0.721 . . . . 0.0 110.235 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -136.69 159.83 40.65 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.414 -0.804 . . . . 0.0 109.793 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -87.18 119.23 27.2 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.453 0.644 . . . . 0.0 109.735 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.6 m -130.93 152.83 81.32 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -41.74 114.11 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.722 1.615 . . . . 0.0 111.282 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.48 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 64.7 t80 -111.47 121.32 44.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.595 -0.691 . . . . 0.0 109.644 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 59' ' ' SER . . . -143.56 154.98 44.15 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.326 -0.859 . . . . 0.0 108.985 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 80.0 mt -112.31 132.46 54.95 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -113.09 131.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.419 ' NH2' ' OD1' ' A' ' 37' ' ' ASP . 58.4 ttm-85 -132.67 136.69 46.61 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.605 -0.685 . . . . 0.0 109.689 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -80.19 134.29 36.12 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.689 0.757 . . . . 0.0 109.735 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.9 t -83.27 130.37 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.479 -0.763 . . . . 0.0 110.501 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 126.75 -48.71 0.95 Allowed Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.445 ' O ' ' O ' ' A' ' 36' ' ' PRO . 33.6 m -92.34 151.49 41.51 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.189 -1.183 . . . . 0.0 110.135 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' VAL . 53.0 Cg_exo -48.96 -168.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.349 2.033 . . . . 0.0 113.076 179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.419 ' OD1' ' NH2' ' A' ' 31' ' ' ARG . 67.5 t0 -82.44 93.43 7.23 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.487 -0.758 . . . . 0.0 109.277 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.456 ' CZ ' ' O ' ' A' ' 80' ' ' ASP . 84.8 mtp180 -90.68 161.51 15.33 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.473 -0.767 . . . . 0.0 110.057 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.2 m -45.69 108.76 0.84 Allowed Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.471 -0.768 . . . . 0.0 109.821 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.95 154.13 37.89 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.169 1.913 . . . . 0.0 112.682 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.497 HD12 ' N ' ' A' ' 41' ' ' ILE . 4.3 mp -121.99 130.12 24.86 Favored Pre-proline 0 N--CA 1.494 1.738 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.4 148.93 55.68 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.125 1.883 . . . . 0.0 112.488 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.542 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -119.98 129.99 54.55 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.68 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.3 p -140.05 167.41 22.2 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 47' ' ' GLU . 9.2 t80 -135.58 136.53 24.02 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.637 -0.664 . . . . 0.0 109.626 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -45.38 81.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.373 2.049 . . . . 0.0 112.183 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 45' ' ' TYR . 6.3 pt-20 178.08 133.8 0.07 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -116.61 163.17 16.5 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.725 0.774 . . . . 0.0 109.491 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.512 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 90.0 m-85 -145.15 -35.24 0.32 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.583 -0.698 . . . . 0.0 109.257 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 49' ' ' TYR . 5.4 t0 79.84 -18.12 0.53 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 51' ' ' LEU . 3.6 mm? -98.98 126.36 44.66 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 122.185 0.993 . . . . 0.0 110.153 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -32.25 73.7 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.548 ' HB1' HH12 ' A' ' 57' ' ' ARG . . . -61.88 -51.79 66.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.307 -0.871 . . . . 0.0 109.914 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.512 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 39.2 t0 -72.14 -36.76 69.45 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.711 0.767 . . . . 0.0 109.486 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.08 -47.37 85.49 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.424 -0.798 . . . . 0.0 109.922 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -64.42 -45.1 89.01 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.548 HH12 ' HB1' ' A' ' 53' ' ' ALA . 84.8 mtt85 -63.87 -45.09 91.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.127 -0.983 . . . . 0.0 109.924 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.3 t -67.56 -42.34 86.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.333 -0.854 . . . . 0.0 109.093 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.575 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 99.9 p -55.76 -40.61 72.84 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.446 -0.784 . . . . 0.0 109.668 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.1 mt -64.94 -45.01 96.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.95 -1.094 . . . . 0.0 109.646 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.44 -42.26 79.11 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.048 -1.033 . . . . 0.0 109.549 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 90.6 m -68.55 -39.16 81.19 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.459 -0.776 . . . . 0.0 109.476 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.85 -46.79 71.34 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.238 -0.914 . . . . 0.0 109.064 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -63.17 -41.73 99.28 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.39 -42.79 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.823 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.2 mm -63.69 -43.24 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 121.04 -1.037 . . . . 0.0 109.191 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 91.8 mt -62.88 -47.71 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 120.993 -1.067 . . . . 0.0 109.377 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -66.14 -44.12 85.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.381 -0.824 . . . . 0.0 109.698 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.55 ' O ' ' N ' ' A' ' 73' ' ' ARG . 11.8 t -63.23 -41.43 99.11 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.487 -0.758 . . . . 0.0 109.315 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.519 ' O ' ' N ' ' A' ' 74' ' ' HIS . 73.5 t60 -58.77 -39.08 79.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.423 -0.798 . . . . 0.0 109.634 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.481 ' O ' ' NE2' ' A' ' 74' ' ' HIS . 85.5 mt -63.4 -42.54 98.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.223 -0.923 . . . . 0.0 110.112 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -94.24 -13.8 26.18 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.234 -0.917 . . . . 0.0 110.192 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.55 ' N ' ' O ' ' A' ' 69' ' ' SER . 65.2 ttt180 -106.98 -41.75 5.1 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.311 -0.868 . . . . 0.0 109.6 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.519 ' N ' ' O ' ' A' ' 70' ' ' HIS . 89.3 m-70 56.5 75.7 0.34 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.964 0.888 . . . . 0.0 109.324 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.52 ' O ' ' CB ' ' A' ' 76' ' ' GLN . 42.0 p-10 -93.6 16.04 14.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.676 -0.64 . . . . 0.0 109.398 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 75' ' ' ASP . 2.5 tm0? 82.76 -24.2 0.18 Allowed 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.535 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . -64.36 154.0 48.26 Favored Glycine 0 N--CA 1.493 2.444 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.089 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 18.8 mt 63.04 -9.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 122.004 -0.704 . . . . 0.0 110.23 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.535 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.9 -34.17 77.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.003 -1.06 . . . . 0.0 109.435 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.466 ' HB2' HD11 ' A' ' 41' ' ' ILE . 99.2 m-20 -65.01 -13.95 59.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.428 -0.795 . . . . 0.0 109.474 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.99 -5.17 59.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.22 -0.925 . . . . 0.0 109.003 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 CA-C-O 117.79 -1.561 . . . . 0.0 109.321 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mtm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -86.44 -4.13 59.12 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.567 -0.708 . . . . 0.0 109.134 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.54 149.8 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.356 -0.84 . . . . 0.0 110.006 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.22 135.44 54.68 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.637 -0.664 . . . . 0.0 109.28 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m170 -84.6 146.7 27.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.429 -0.794 . . . . 0.0 110.373 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -154.6 119.16 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.527 -0.733 . . . . 0.0 109.117 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? 54.69 26.81 7.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.627 -0.67 . . . . 0.0 109.921 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 87.63 2.8 81.59 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -107.45 140.08 40.96 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.553 -0.969 . . . . 0.0 109.709 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -89.92 142.08 28.04 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.5 -0.75 . . . . 0.0 109.476 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -123.97 132.75 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -119.91 87.95 39.35 Favored Pre-proline 0 N--CA 1.496 1.835 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.66 149.4 68.12 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 122.734 2.289 . . . . 0.0 112.463 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.24 139.68 4.69 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 15' ' ' HIS . 45.2 p-80 -95.1 123.23 38.48 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.521 -0.988 . . . . 0.0 109.96 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -149.91 153.16 36.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.156 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -104.36 138.9 40.1 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.636 -0.665 . . . . 0.0 109.468 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -103.02 141.9 35.02 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.489 0.661 . . . . 0.0 110.349 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -68.77 -8.81 46.57 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.292 -0.88 . . . . 0.0 109.378 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -68.06 -52.86 30.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.49 ' CD1' ' H ' ' A' ' 23' ' ' LYS . 1.2 pp -108.26 7.27 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 40.89 37.92 0.59 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.823 -0.548 . . . . 0.0 110.123 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' H ' ' CD1' ' A' ' 21' ' ' ILE . 34.7 mmtt -141.16 176.79 8.55 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.352 -0.843 . . . . 0.0 109.706 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -86.82 127.43 35.01 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.303 0.573 . . . . 0.0 109.633 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -138.61 154.75 73.52 Favored Pre-proline 0 N--CA 1.493 1.681 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -58.52 110.29 0.63 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.239 1.959 . . . . 0.0 111.496 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -112.62 118.4 34.96 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.514 -0.741 . . . . 0.0 109.37 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 43' ' ' THR . . . -144.01 153.6 42.39 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -102.82 133.88 47.16 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.634 -0.666 . . . . 0.0 109.554 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.3 mt -110.0 128.07 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -136.41 138.86 41.98 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.628 -0.67 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -93.61 134.69 35.65 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.474 -0.766 . . . . 0.0 109.556 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.439 ' C ' ' H ' ' A' ' 35' ' ' VAL . 91.2 t -63.23 -43.79 98.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.589 -0.694 . . . . 0.0 110.224 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.55 3.3 1.96 Allowed Glycine 0 N--CA 1.492 2.388 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.439 ' H ' ' C ' ' A' ' 33' ' ' VAL . 4.8 t -146.54 71.2 12.82 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.066 -1.255 . . . . 0.0 109.195 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.437 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 31.7 Cg_exo -56.24 -43.86 52.04 Favored 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.18 1.92 . . . . 0.0 111.376 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -95.82 112.16 23.96 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.423 0.63 . . . . 0.0 109.719 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.515 ' HE ' ' C ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -168.63 -165.24 0.56 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.1 m -112.0 97.6 38.95 Favored Pre-proline 0 N--CA 1.496 1.828 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.54 143.49 55.87 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 122.35 2.034 . . . . 0.0 112.127 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 5.3 mp -124.03 125.04 25.89 Favored Pre-proline 0 N--CA 1.491 1.601 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -71.63 143.96 43.37 Favored 'Trans proline' 0 N--CA 1.49 1.266 0 C-N-CA 121.842 1.694 . . . . 0.0 112.278 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 28' ' ' ALA . 1.3 t -107.2 137.0 46.09 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -130.52 165.07 23.48 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.536 ' O ' ' N ' ' A' ' 47' ' ' GLU . 24.2 t80 -139.1 110.74 7.81 Favored Pre-proline 0 N--CA 1.491 1.599 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -45.53 83.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.966 1.777 . . . . 0.0 112.33 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 45' ' ' TYR . 8.4 tm-20 -171.91 132.24 0.69 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.252 -0.905 . . . . 0.0 109.085 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -98.9 125.66 44.37 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 108.991 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.526 ' CE2' ' OE1' ' A' ' 47' ' ' GLU . 84.8 m-85 -109.03 -32.37 7.27 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.6 t0 62.97 -3.8 0.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 49' ' ' TYR . 95.4 mt -115.47 131.54 56.9 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.595 -0.691 . . . . 0.0 109.737 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -68.47 -39.43 81.39 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.651 -0.656 . . . . 0.0 109.818 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -50.34 74.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.74 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -64.34 -40.2 95.41 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.46 -0.775 . . . . 0.0 109.427 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.77 92.81 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.476 -0.765 . . . . 0.0 109.95 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -66.98 -49.37 65.6 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.403 -0.81 . . . . 0.0 110.1 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -64.98 -44.2 90.1 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.334 -0.854 . . . . 0.0 109.659 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 74.7 t -66.7 -42.37 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.56 -0.712 . . . . 0.0 109.564 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.2 p -54.72 -40.41 69.22 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.245 -0.909 . . . . 0.0 109.549 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -65.22 -45.02 95.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 121.204 -0.935 . . . . 0.0 109.368 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.34 51.83 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.404 -0.81 . . . . 0.0 109.733 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.1 m -60.92 -38.9 87.36 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.557 -0.715 . . . . 0.0 109.28 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.86 -41.12 70.42 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.46 -0.775 . . . . 0.0 109.188 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.18 -38.71 92.24 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.338 -0.852 . . . . 0.0 109.123 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.56 -45.79 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.453 -0.779 . . . . 0.0 109.665 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.35 -44.35 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.339 -0.851 . . . . 0.0 108.746 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.68 -44.36 96.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.313 -0.867 . . . . 0.0 109.272 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.49 -41.51 96.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.563 -0.711 . . . . 0.0 109.573 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.514 ' O ' ' N ' ' A' ' 73' ' ' ARG . 50.8 m -61.58 -41.99 98.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.529 -0.732 . . . . 0.0 110.012 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -61.21 -47.16 87.4 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.125 -0.984 . . . . 0.0 109.467 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.87 -42.2 95.03 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.481 -0.762 . . . . 0.0 109.321 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -82.39 -70.08 0.57 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.553 -0.717 . . . . 0.0 109.653 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' SER . 85.8 mtp180 -73.88 147.63 43.05 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.533 -0.73 . . . . 0.0 110.098 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -78.4 62.24 2.99 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 0.0 109.048 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 77' ' ' GLY . 62.2 t0 -87.65 110.82 20.68 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.482 -0.761 . . . . 0.0 109.699 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -68.92 11.57 0.19 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.525 -0.734 . . . . 0.0 109.533 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.504 ' H ' ' C ' ' A' ' 75' ' ' ASP . . . -60.73 -40.97 98.82 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.689 -1.365 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 34.3 mt -112.16 32.68 5.35 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.959 . . . . 0.0 109.138 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.71 88.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.553 -0.717 . . . . 0.0 109.554 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.69 -34.77 79.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.595 -0.691 . . . . 0.0 109.899 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.2 mt -80.18 -2.93 46.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.617 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 CA-C-O 117.866 -1.519 . . . . 0.0 109.428 179.747 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.41 ' O ' ' O ' ' A' ' 2' ' ' ASN . 37.7 ttm . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.41 ' O ' ' O ' ' A' ' 1' ' ' MET . 99.5 m-20 42.96 -168.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.712 0.768 . . . . 0.0 111.043 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.4 m -75.04 141.35 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.688 0.756 . . . . 0.0 110.264 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.04 131.3 43.98 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.76 0.79 . . . . 0.0 109.706 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -83.86 149.26 26.49 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.671 0.748 . . . . 0.0 110.184 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -153.43 113.65 3.96 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.763 0.792 . . . . 0.0 109.401 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.8 mtp180 49.41 29.52 2.88 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.631 0.729 . . . . 0.0 110.104 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 96.23 -19.61 53.77 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -83.71 142.14 30.95 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -1.029 . . . . 0.0 110.625 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -94.49 145.81 24.53 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.624 -0.673 . . . . 0.0 109.604 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 94.6 mt -125.21 129.72 73.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-O 121.483 0.659 . . . . 0.0 109.483 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -123.68 93.23 47.73 Favored Pre-proline 0 N--CA 1.495 1.781 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.49 157.46 32.58 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.759 2.306 . . . . 0.0 113.209 -178.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.3 -133.71 1.75 Allowed Glycine 0 N--CA 1.488 2.153 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.545 ' ND1' ' OE2' ' A' ' 52' ' ' GLU . 20.2 p-80 -160.05 135.67 8.33 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.435 -1.038 . . . . 0.0 109.899 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.525 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 54.2 tt0 -166.62 154.4 9.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.639 -0.663 . . . . 0.0 109.301 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.9 p90 -112.79 144.62 42.01 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-O 121.711 0.767 . . . . 0.0 109.942 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.693 ' HE ' HG21 ' A' ' 44' ' ' THR . 94.6 mtt-85 -99.15 137.67 37.35 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.622 0.725 . . . . 0.0 109.969 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -68.21 -20.31 64.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.774 -0.579 . . . . 0.0 109.886 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -65.37 -42.43 92.75 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.314 -0.866 . . . . 0.0 109.917 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 11.4 pt -109.91 -6.16 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.47 -0.769 . . . . 0.0 109.016 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 48.25 44.13 19.45 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.807 0.813 . . . . 0.0 109.964 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -145.56 163.21 35.49 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.509 -0.745 . . . . 0.0 110.202 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -86.22 132.12 34.08 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.843 0.83 . . . . 0.0 110.229 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.8 m -142.49 148.72 48.22 Favored Pre-proline 0 N--CA 1.491 1.592 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -39.94 109.99 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.395 2.063 . . . . 0.0 111.416 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.525 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 56.1 t80 -104.08 120.29 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.603 0.716 . . . . 0.0 109.961 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.617 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -142.13 145.8 34.65 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.496 -0.753 . . . . 0.0 109.097 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.41 HD21 ' CE2' ' A' ' 27' ' ' TYR . 65.7 mt -110.14 126.57 54.2 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 91.0 mt -104.05 127.45 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 CA-C-O 121.516 0.674 . . . . 0.0 109.532 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -130.1 137.98 50.45 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 121.59 0.71 . . . . 0.0 109.464 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -95.2 130.53 41.9 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 109.28 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.74 131.41 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.3 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 122.98 -38.76 2.42 Favored Glycine 0 N--CA 1.497 2.736 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.6 m -152.86 58.51 2.46 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.321 -1.105 . . . . 0.0 110.003 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -74.5 -170.88 0.8 Allowed 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.356 2.037 . . . . 0.0 111.965 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 56.34 36.45 27.53 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.606 0.717 . . . . 0.0 109.298 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.413 ' O ' ' C ' ' A' ' 39' ' ' THR . 23.5 mmt180 -117.62 90.02 3.24 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.507 0.67 . . . . 0.0 109.684 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.413 ' C ' ' O ' ' A' ' 38' ' ' ARG . 7.8 m 42.31 81.11 0.26 Allowed Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.71 144.14 98.2 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.348 2.032 . . . . 0.0 112.393 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.14 89.97 51.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -52.87 141.6 55.04 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 C-N-CA 122.517 2.145 . . . . 0.0 112.227 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.617 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 12.1 t -108.65 134.61 51.15 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.812 0.815 . . . . 0.0 110.003 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.693 HG21 ' HE ' ' A' ' 18' ' ' ARG . 56.9 p -139.66 166.85 23.5 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.608 ' O ' ' N ' ' A' ' 47' ' ' GLU . 8.8 t80 -136.05 133.42 19.7 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -42.78 76.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.898 2.399 . . . . 0.0 112.382 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.608 ' N ' ' O ' ' A' ' 45' ' ' TYR . 39.8 mt-10 -155.06 145.05 21.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.564 -0.71 . . . . 0.0 109.131 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -115.39 110.15 18.93 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.696 -0.628 . . . . 0.0 109.345 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.419 ' CE2' HG21 ' A' ' 58' ' ' VAL . 48.6 m-85 -124.28 129.79 51.37 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.557 0.694 . . . . 0.0 109.669 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -92.99 -24.84 18.23 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -78.68 143.02 36.67 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.826 0.822 . . . . 0.0 110.323 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.545 ' OE2' ' ND1' ' A' ' 15' ' ' HIS . 46.2 tp10 -71.89 -38.49 69.97 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.578 0.704 . . . . 0.0 109.758 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.97 87.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.79 . . . . 0.0 109.862 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 58' ' ' VAL . 34.9 m-20 -63.68 -43.43 96.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 109.739 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.12 88.89 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.512 -0.743 . . . . 0.0 109.899 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -69.37 -45.08 70.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.487 -0.758 . . . . 0.0 110.08 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -64.07 -45.4 88.88 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.335 -0.853 . . . . 0.0 110.037 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.419 HG21 ' CE2' ' A' ' 49' ' ' TYR . 75.7 t -67.53 -41.79 86.24 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.558 0.694 . . . . 0.0 109.742 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.52 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 88.1 p -57.18 -42.43 81.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.37 -0.831 . . . . 0.0 110.045 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.87 -45.07 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.117 -0.989 . . . . 0.0 109.645 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.89 -49.45 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.222 -0.924 . . . . 0.0 109.805 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.1 m -61.82 -35.19 77.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.473 -0.767 . . . . 0.0 109.485 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.55 -41.03 89.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.395 -0.815 . . . . 0.0 109.523 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -64.26 -45.74 86.78 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.296 -0.877 . . . . 0.0 109.805 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.404 ' N ' HD12 ' A' ' 65' ' ' ILE . 3.0 mp -67.47 -42.08 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.369 -0.832 . . . . 0.0 109.818 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -62.22 -43.74 98.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 121.384 -0.822 . . . . 0.0 109.789 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.4 mt -63.95 -44.71 98.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.228 -0.92 . . . . 0.0 109.319 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.457 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 73.9 m-20 -64.24 -44.06 92.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.378 -0.826 . . . . 0.0 109.264 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.414 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 77.2 p -64.47 -47.6 78.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 0.0 109.768 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.705 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 53.8 t60 -47.06 -44.02 20.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.293 -0.879 . . . . 0.0 109.441 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.402 HD13 HH22 ' A' ' 7' ' ' ARG . 90.0 mt -63.34 -40.72 98.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.38 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -135.57 72.57 1.45 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.453 -0.779 . . . . 0.0 109.266 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.414 ' CB ' ' O ' ' A' ' 69' ' ' SER . 11.0 tpp85 -174.06 -127.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.511 0.672 . . . . 0.0 109.973 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -51.47 130.91 28.56 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.92 0.867 . . . . 0.0 110.347 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.4 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 49.6 p-10 -65.05 136.07 56.32 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 121.741 0.782 . . . . 0.0 110.707 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 57.58 156.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.802 0.81 . . . . 0.0 110.784 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.12 -74.05 0.18 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.705 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 59.5 mt -102.59 14.65 31.42 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.326 -1.102 . . . . 0.0 109.201 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.12 -26.08 68.38 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.505 -0.747 . . . . 0.0 109.9 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -68.08 -17.16 64.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.325 -0.859 . . . . 0.0 109.676 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 78.9 mt -92.93 -2.13 56.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.186 -0.947 . . . . 0.0 109.262 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.807 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 tpp . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -86.4 114.88 23.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.444 -0.785 . . . . 0.0 109.975 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.8 m -81.14 151.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 CA-C-O 121.666 0.746 . . . . 0.0 110.441 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.8 139.89 48.05 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -101.63 122.48 43.95 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.737 0.779 . . . . 0.0 109.876 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -101.69 -101.12 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.403 0.621 . . . . 0.0 109.509 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -90.96 51.46 1.96 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.361 -0.837 . . . . 0.0 109.546 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.7 90.51 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.06 138.19 44.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.506 -0.997 . . . . 0.0 109.896 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -80.45 141.07 35.6 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.629 -0.669 . . . . 0.0 109.379 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.6 mt -119.47 129.0 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.38 0.61 . . . . 0.0 109.448 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -132.22 97.97 17.58 Favored Pre-proline 0 N--CA 1.491 1.614 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -76.94 154.11 33.3 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.622 2.215 . . . . 0.0 112.868 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.2 102.89 0.17 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 p-80 -42.05 129.68 3.6 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.69 -0.888 . . . . 0.0 110.713 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.441 ' CD ' ' H ' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -156.93 158.1 36.02 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 121.614 0.721 . . . . 0.0 109.427 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.441 ' H ' ' CD ' ' A' ' 16' ' ' GLN . 48.3 p90 -113.5 145.8 40.63 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.817 0.817 . . . . 0.0 110.038 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.636 HH21 ' CG2' ' A' ' 44' ' ' THR . 32.3 mmt180 -92.51 130.75 38.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.767 0.794 . . . . 0.0 109.612 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 45.1 p-10 -71.72 -23.78 61.68 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.73 -0.606 . . . . 0.0 109.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 90.7 m-20 -61.79 -44.64 96.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.6 pt -109.39 -7.63 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.378 -0.826 . . . . 0.0 109.102 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 54.8 53.43 10.51 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.591 0.71 . . . . 0.0 110.197 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -146.53 162.36 38.51 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.383 -0.823 . . . . 0.0 110.377 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -88.14 128.53 35.44 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.617 -0.677 . . . . 0.0 109.664 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.8 m -147.14 148.24 31.45 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.484 -0.76 . . . . 0.0 109.391 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -42.47 109.23 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 122.282 1.988 . . . . 0.0 111.508 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.407 ' OH ' HD21 ' A' ' 29' ' ' LEU . 75.0 t80 -112.39 120.96 43.47 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.347 -0.846 . . . . 0.0 110.163 -179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.807 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -137.72 145.67 42.79 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.427 HD13 ' NH2' ' A' ' 31' ' ' ARG . 83.1 mt -101.78 130.26 48.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.537 -0.727 . . . . 0.0 109.301 -179.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 93.1 mt -109.64 124.4 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 CA-C-O 121.579 0.704 . . . . 0.0 109.901 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.427 ' NH2' HD13 ' A' ' 29' ' ' LEU . 3.9 mpt_? -130.61 140.44 50.42 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.644 0.735 . . . . 0.0 109.572 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -86.9 137.25 32.54 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-O 121.606 0.717 . . . . 0.0 109.643 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.3 t -67.17 132.47 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 CA-C-O 121.806 0.812 . . . . 0.0 110.583 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 102.39 -20.65 43.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.441 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 27.9 m -152.66 53.22 1.0 Allowed Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.364 -1.08 . . . . 0.0 110.094 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 64.6 Cg_endo -74.1 -11.78 23.35 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.736 2.29 . . . . 0.0 110.815 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -75.02 -4.91 41.12 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.61 -0.681 . . . . 0.0 109.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.447 ' O ' ' C ' ' A' ' 39' ' ' THR . 37.7 mmt180 -81.2 144.14 31.83 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.385 -0.822 . . . . 0.0 110.241 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 38' ' ' ARG . 24.9 m -35.04 98.42 0.15 Allowed Pre-proline 0 N--CA 1.495 1.797 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.203 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.08 146.91 46.14 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.427 2.085 . . . . 0.0 112.721 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -109.75 111.02 59.19 Favored Pre-proline 0 N--CA 1.493 1.701 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.55 157.42 44.67 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 122.546 2.164 . . . . 0.0 112.461 -179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.807 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 1.0 OUTLIER -121.97 135.55 54.86 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.577 0.703 . . . . 0.0 109.71 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.636 ' CG2' HH21 ' A' ' 18' ' ' ARG . 43.7 p -131.03 166.84 20.14 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' A' ' 47' ' ' GLU . 1.1 t80 -135.58 133.19 20.08 Favored Pre-proline 0 N--CA 1.491 1.595 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.509 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 77.1 Cg_exo -45.23 -12.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.313 2.009 . . . . 0.0 111.468 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.516 ' N ' ' O ' ' A' ' 45' ' ' TYR . 97.0 mt-10 -84.0 160.27 21.05 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.57 -0.706 . . . . 0.0 109.937 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -131.28 148.65 52.71 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.598 0.713 . . . . 0.0 109.362 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.527 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 62.4 m-85 -149.62 118.91 6.82 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.477 -0.765 . . . . 0.0 109.241 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -74.12 -13.39 60.82 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.2 mt -94.67 128.54 41.4 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 109.877 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -67.79 -36.15 79.93 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.483 0.659 . . . . 0.0 110.19 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.36 -43.87 92.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.365 -0.834 . . . . 0.0 109.753 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 51.3 t0 -65.94 -38.85 89.7 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.417 -0.802 . . . . 0.0 109.544 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.95 -37.07 86.07 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.531 -0.731 . . . . 0.0 109.595 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -64.48 -50.24 68.23 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.392 -0.818 . . . . 0.0 109.807 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -67.27 -44.06 80.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.833 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 54' ' ' ASP . 74.4 t -67.4 -42.98 87.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.457 -0.777 . . . . 0.0 110.238 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.487 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 77.8 p -59.6 -41.08 89.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 110.206 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -65.83 -44.44 92.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 120.987 -1.07 . . . . 0.0 109.473 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -45.2 76.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.437 -0.789 . . . . 0.0 109.898 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.57 -46.38 72.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.361 -0.837 . . . . 0.0 109.985 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -48.2 -46.15 34.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.448 -0.783 . . . . 0.0 109.799 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.34 -41.82 98.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.361 -0.837 . . . . 0.0 109.418 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 91.0 mt -64.47 -44.03 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.505 -0.747 . . . . 0.0 109.691 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.15 -43.99 99.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.01 -44.03 99.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 O-C-N 121.583 -0.698 . . . . 0.0 109.2 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.23 -42.62 93.2 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.668 0.747 . . . . 0.0 109.301 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' ARG . 38.7 t -69.92 -34.12 73.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.554 -0.716 . . . . 0.0 109.789 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.498 ' ND1' HD12 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -57.75 -47.74 81.62 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.282 -0.886 . . . . 0.0 108.78 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.5 mt -64.25 -40.32 95.77 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -82.46 -78.86 0.19 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.508 0.67 . . . . 0.0 109.711 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 69' ' ' SER . 84.8 mtt85 -80.54 147.18 30.93 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.682 0.753 . . . . 0.0 110.669 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.411 ' O ' ' O ' ' A' ' 73' ' ' ARG . 62.5 m170 58.22 121.89 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.803 0.811 . . . . 0.0 110.417 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -93.4 -18.45 22.35 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.399 -0.813 . . . . 0.0 109.175 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.41 ' O ' ' C ' ' A' ' 77' ' ' GLY . 99.0 mm-40 -80.95 -6.33 58.58 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.317 -0.865 . . . . 0.0 109.576 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.41 ' C ' ' O ' ' A' ' 76' ' ' GLN . . . -39.31 -82.66 0.02 OUTLIER Glycine 0 N--CA 1.5 2.916 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.498 HD12 ' ND1' ' A' ' 70' ' ' HIS . 46.5 mt -109.84 32.96 4.67 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.514 -0.992 . . . . 0.0 108.854 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.42 76.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.519 -0.738 . . . . 0.0 109.315 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -63.92 -37.44 87.4 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.424 -0.797 . . . . 0.0 109.261 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 82.5 mt -86.8 -5.69 59.04 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.096 -1.002 . . . . 0.0 108.805 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.92 -1.489 . . . . 0.0 109.413 179.507 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.4 tpp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -84.9 143.45 29.01 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 110.156 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m -87.94 154.91 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-O 121.813 0.816 . . . . 0.0 110.631 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.29 146.77 31.1 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -102.83 136.9 41.8 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-O 121.741 0.781 . . . . 0.0 110.217 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -149.38 120.69 7.85 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.77 0.795 . . . . 0.0 109.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 48.98 30.84 2.96 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 121.741 0.781 . . . . 0.0 110.452 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.32 -20.26 41.85 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -81.02 144.16 31.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.341 -1.093 . . . . 0.0 110.299 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -104.32 139.07 39.83 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -115.01 137.57 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.648 0.737 . . . . 0.0 110.122 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -118.65 90.0 38.74 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.62 145.85 46.33 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.947 2.431 . . . . 0.0 112.907 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.28 -171.95 40.53 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -149.15 141.02 23.68 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.502 -0.999 . . . . 0.0 109.773 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -170.02 155.74 5.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.587 -0.696 . . . . 0.0 109.514 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -105.3 137.9 42.36 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-O 121.861 0.838 . . . . 0.0 110.146 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.4 141.16 36.44 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.389 0.614 . . . . 0.0 109.585 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 37.4 p-10 -68.44 -8.28 39.3 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.756 0.789 . . . . 0.0 109.349 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -64.27 -42.44 96.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.392 -0.818 . . . . 0.0 109.205 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.412 ' O ' ' C ' ' A' ' 22' ' ' ARG . 1.1 pp -122.58 12.71 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ILE . 89.0 mtm180 38.48 34.62 0.08 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.632 0.729 . . . . 0.0 110.102 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -138.35 169.12 18.35 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 122.054 0.931 . . . . 0.0 110.359 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -85.3 135.37 33.94 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 121.635 0.731 . . . . 0.0 109.891 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -147.37 147.64 28.94 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.377 -0.827 . . . . 0.0 109.493 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -38.19 109.21 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 C-N-CA 122.685 2.257 . . . . 0.0 111.65 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -109.05 112.0 23.94 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.16 145.7 37.84 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.529 -0.732 . . . . 0.0 109.424 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -102.92 124.87 49.25 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -112.36 133.26 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-O 121.461 0.648 . . . . 0.0 109.797 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.99 138.33 43.89 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.613 0.721 . . . . 0.0 109.355 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -83.28 134.76 34.92 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.707 0.765 . . . . 0.0 110.267 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.1 t -70.61 134.25 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-O 121.732 0.777 . . . . 0.0 110.5 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.86 -14.26 31.84 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 108.707 -1.757 . . . . 0.0 108.707 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.442 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 15.6 m -153.28 53.53 1.01 Allowed Pre-proline 0 N--CA 1.49 1.546 0 O-C-N 121.237 -1.155 . . . . 0.0 109.636 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 42.8 Cg_endo -72.04 -10.74 26.47 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.643 2.228 . . . . 0.0 111.106 179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -74.38 -4.42 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.486 -0.758 . . . . 0.0 109.051 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.515 ' NH1' ' O ' ' A' ' 81' ' ' LEU . 91.8 mtt180 -86.99 137.94 31.93 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.91 0.862 . . . . 0.0 110.607 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -52.36 121.77 22.28 Favored Pre-proline 0 N--CA 1.487 1.407 0 O-C-N 121.886 -0.509 . . . . 0.0 110.435 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.76 151.96 52.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.71 2.274 . . . . 0.0 112.984 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.509 HD11 ' HB2' ' A' ' 80' ' ' ASP . 4.2 mp -118.38 130.89 24.49 Favored Pre-proline 0 N--CA 1.495 1.78 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.04 145.98 45.88 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 122.523 2.148 . . . . 0.0 112.246 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 14.9 t -116.52 137.13 52.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.627 -0.671 . . . . 0.0 109.703 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -138.22 167.65 21.38 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.309 0.576 . . . . 0.0 109.666 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -126.83 145.21 52.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.48 ' O ' ' CE1' ' A' ' 48' ' ' PHE . 81.6 Cg_exo -43.2 -26.31 0.82 Allowed 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.24 1.96 . . . . 0.0 111.574 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -69.73 160.4 31.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.744 . . . . 0.0 110.515 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 46' ' ' PRO . 73.2 m-85 -128.37 146.55 50.74 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.544 0.688 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.518 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 71.8 m-85 -148.55 121.91 9.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.469 -0.769 . . . . 0.0 109.877 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -82.59 -20.18 36.98 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -81.77 136.31 35.43 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.34 -0.85 . . . . 0.0 109.881 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.86 -40.58 72.23 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.61 0.719 . . . . 0.0 109.778 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.96 99.23 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.411 -0.806 . . . . 0.0 109.807 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.518 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 54.1 t0 -65.26 -39.63 92.9 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.41 -0.806 . . . . 0.0 109.906 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.1 95.0 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.261 -0.899 . . . . 0.0 109.839 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.94 -46.02 76.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.31 -0.869 . . . . 0.0 109.858 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.57 -44.3 91.12 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.236 -0.915 . . . . 0.0 109.95 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 76.3 t -66.83 -41.71 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.496 -0.752 . . . . 0.0 109.906 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 88.2 p -56.95 -41.28 78.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.325 -0.86 . . . . 0.0 109.989 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.12 -45.76 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.023 -1.048 . . . . 0.0 109.66 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.52 -53.72 26.17 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.271 -0.893 . . . . 0.0 109.929 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 95.7 m -62.95 -35.66 80.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.387 -0.821 . . . . 0.0 109.809 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.51 ' HB2' ' O ' ' A' ' 59' ' ' SER . . . -55.65 -43.26 76.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.165 -0.96 . . . . 0.0 108.818 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -63.16 -39.66 95.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 0.0 108.747 179.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -64.92 -43.62 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.308 -0.87 . . . . 0.0 108.736 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.0 mm -64.29 -43.93 97.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 121.725 0.774 . . . . 0.0 109.555 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -64.21 -44.24 97.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.644 0 O-C-N 121.464 -0.772 . . . . 0.0 109.4 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -64.88 -45.22 86.9 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.81 0.814 . . . . 0.0 109.554 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.5 m -62.78 -38.95 92.66 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.429 -0.794 . . . . 0.0 109.868 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.499 ' CE1' ' O ' ' A' ' 77' ' ' GLY . 79.4 t60 -60.82 -40.95 94.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.21 -0.931 . . . . 0.0 109.852 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.09 -41.73 99.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.373 -0.829 . . . . 0.0 109.823 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -79.69 -63.73 1.35 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.16 -0.962 . . . . 0.0 108.991 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -171.17 132.61 0.82 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 109.493 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.419 ' CG ' ' N ' ' A' ' 75' ' ' ASP . 76.6 t60 -161.56 168.22 23.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.321 -0.862 . . . . 0.0 109.536 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.51 ' CG ' ' H ' ' A' ' 76' ' ' GLN . 43.9 t0 -84.24 -176.64 6.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.565 -0.71 . . . . 0.0 110.437 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.51 ' H ' ' CG ' ' A' ' 75' ' ' ASP . 17.0 tm0? -39.15 92.74 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.723 0.773 . . . . 0.0 110.495 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 75' ' ' ASP . . . -164.77 122.42 1.08 Allowed Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.3 mt 59.65 1.16 0.27 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.724 -0.868 . . . . 0.0 109.58 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.17 -34.46 78.13 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.483 -0.761 . . . . 0.0 109.431 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.509 ' HB2' HD11 ' A' ' 41' ' ' ILE . 98.5 m-20 -61.98 -41.05 97.6 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.251 -0.906 . . . . 0.0 109.794 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.515 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 57.0 mt -63.53 -40.32 96.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.301 -0.875 . . . . 0.0 109.477 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 -179.899 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.7 mmm . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.776 0.798 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 43.02 -100.12 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.658 0.742 . . . . 0.0 110.314 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.1 m -91.64 152.93 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.339 -0.851 . . . . 0.0 110.201 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.18 137.42 51.48 Favored 'General case' 0 N--CA 1.496 1.872 0 CA-C-O 121.696 0.76 . . . . 0.0 109.792 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -82.25 151.2 26.92 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.614 0.721 . . . . 0.0 110.086 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -154.51 111.84 3.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.445 ' NH2' ' CD1' ' A' ' 71' ' ' LEU . 84.1 mtp180 49.75 35.59 9.33 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.69 0.757 . . . . 0.0 110.534 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.32 -5.76 83.87 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -105.41 137.34 43.37 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.239 -1.154 . . . . 0.0 110.252 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -89.22 144.85 25.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.746 -0.596 . . . . 0.0 109.461 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.74 130.04 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-O 121.424 0.63 . . . . 0.0 109.391 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.594 ' O ' ' HB1' ' A' ' 28' ' ' ALA . 49.6 tt0 -121.26 117.95 30.27 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.98 154.22 42.44 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.609 2.206 . . . . 0.0 113.023 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.43 -167.3 39.2 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -151.07 156.01 40.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.511 -0.993 . . . . 0.0 109.509 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' OE1' ' CE1' ' A' ' 27' ' ' TYR . 57.4 tt0 -152.98 154.1 34.28 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.544 -0.723 . . . . 0.0 109.08 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -107.95 123.92 49.36 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.777 0.799 . . . . 0.0 110.159 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -96.92 138.3 34.68 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 121.797 0.808 . . . . 0.0 109.41 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -86.94 -24.29 24.82 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 109.41 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.32 -44.91 93.6 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.432 -0.793 . . . . 0.0 109.543 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.433 ' O ' ' C ' ' A' ' 22' ' ' ARG . 19.7 pt -105.6 9.99 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.449 -0.782 . . . . 0.0 108.994 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.433 ' C ' ' O ' ' A' ' 21' ' ' ILE . 51.8 ptt85 35.8 41.78 0.12 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.655 0.741 . . . . 0.0 110.803 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -146.71 160.63 41.99 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.312 -0.868 . . . . 0.0 110.427 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -85.54 137.48 32.85 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 121.536 0.684 . . . . 0.0 109.854 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.3 m -139.39 151.63 67.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.673 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -45.42 134.3 12.44 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.429 2.086 . . . . 0.0 112.223 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.527 ' CE1' ' OE1' ' A' ' 16' ' ' GLN . 71.9 t80 -140.31 113.81 8.64 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.378 -0.826 . . . . 0.0 109.56 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.594 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -138.69 151.12 46.89 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.584 0.707 . . . . 0.0 109.267 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.8 mt -101.74 128.34 48.11 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.587 0.708 . . . . 0.0 109.481 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 95.1 mt -108.62 129.55 62.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.718 ' NE ' HH22 ' A' ' 38' ' ' ARG . 9.4 mmm180 -117.04 136.11 53.21 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 121.717 0.77 . . . . 0.0 109.356 -179.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -101.89 117.91 35.83 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.759 0.79 . . . . 0.0 109.323 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 6.4 t -77.54 118.92 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-O 121.606 0.717 . . . . 0.0 109.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 133.34 -24.9 3.69 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.464 ' O ' ' O ' ' A' ' 36' ' ' PRO . 3.3 m -104.15 127.55 28.97 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.367 -1.078 . . . . 0.0 110.349 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.464 ' O ' ' O ' ' A' ' 35' ' ' VAL . 50.8 Cg_exo -50.38 -161.09 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.561 2.174 . . . . 0.0 112.791 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.79 144.61 56.35 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.743 0.783 . . . . 0.0 110.641 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.718 HH22 ' NE ' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -160.96 -172.57 3.52 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.812 0.815 . . . . 0.0 110.362 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.5 m -84.73 131.79 48.42 Favored Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.672 -0.643 . . . . 0.0 109.613 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.58 131.75 17.86 Favored 'Trans proline' 0 N--CA 1.493 1.494 0 C-N-CA 122.509 2.139 . . . . 0.0 112.623 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.6 mm -114.49 106.63 52.23 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 121.783 -0.573 . . . . 0.0 109.583 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.478 ' CB ' ' CE1' ' A' ' 27' ' ' TYR . 59.4 Cg_endo -75.6 146.73 30.89 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.472 2.114 . . . . 0.0 112.242 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.15 132.37 53.68 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.612 0.72 . . . . 0.0 109.715 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 p -136.41 167.13 21.91 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 121.389 0.614 . . . . 0.0 109.605 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -131.65 142.14 44.2 Favored Pre-proline 0 N--CA 1.492 1.657 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -45.98 -35.26 14.03 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.197 1.931 . . . . 0.0 111.576 178.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.48 144.67 56.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.52 -0.738 . . . . 0.0 110.01 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -125.51 148.11 49.0 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.66 0.743 . . . . 0.0 109.847 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.67 129.85 33.39 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.745 0.783 . . . . 0.0 109.497 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 64.7 t0 -66.86 -35.66 80.54 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 121.563 0.697 . . . . 0.0 109.523 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 72.4 mt -75.21 135.41 41.03 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 121.953 0.882 . . . . 0.0 110.342 -179.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 56' ' ' GLU . 1.7 tm-20 -72.47 -40.05 67.25 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.717 0.77 . . . . 0.0 109.715 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.2 96.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.394 -0.816 . . . . 0.0 109.872 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -64.17 -36.49 84.21 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.323 -0.86 . . . . 0.0 109.25 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.12 -38.64 89.68 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.403 -0.811 . . . . 0.0 109.182 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.431 ' OE2' ' OE2' ' A' ' 52' ' ' GLU . 97.2 mt-10 -64.39 -45.3 88.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.433 -0.792 . . . . 0.0 109.491 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -64.32 -43.86 93.37 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.375 -0.828 . . . . 0.0 109.677 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.3 -41.55 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.495 -0.753 . . . . 0.0 109.577 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 95.3 p -57.53 -40.38 78.68 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.409 -0.807 . . . . 0.0 109.686 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.2 mt -64.78 -46.07 93.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.187 -0.946 . . . . 0.0 109.471 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.75 -52.64 41.91 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.118 -0.988 . . . . 0.0 109.4 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 92.6 m -59.53 -40.28 86.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.314 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 59' ' ' SER . . . -52.97 -40.13 63.5 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.559 -0.713 . . . . 0.0 109.69 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -61.51 -41.18 96.92 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.222 -0.924 . . . . 0.0 109.311 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.527 HD12 ' N ' ' A' ' 65' ' ' ILE . 1.4 mp -63.92 -43.85 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.26 -0.9 . . . . 0.0 109.542 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.89 -43.22 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.26 -0.9 . . . . 0.0 109.131 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.3 mt -62.77 -43.78 99.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.213 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -64.32 -43.73 93.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.399 -0.813 . . . . 0.0 109.395 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.515 ' O ' ' N ' ' A' ' 73' ' ' ARG . 15.8 m -63.57 -35.92 82.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.443 -0.785 . . . . 0.0 109.389 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.527 ' ND1' ' O ' ' A' ' 77' ' ' GLY . 64.0 t60 -58.83 -42.86 90.25 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.365 -0.834 . . . . 0.0 109.621 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.445 ' CD1' ' NH2' ' A' ' 7' ' ' ARG . 96.3 mt -63.72 -41.25 98.11 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.356 -0.84 . . . . 0.0 109.093 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -85.51 -70.59 0.58 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 109.229 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' SER . 85.9 mtp180 -79.78 145.34 32.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.384 -0.823 . . . . 0.0 110.439 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -124.2 28.69 6.64 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.615 ' C ' ' H ' ' A' ' 77' ' ' GLY . 98.1 m-20 -84.59 89.66 7.5 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.359 -0.838 . . . . 0.0 109.74 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 64.54 -24.76 0.08 Allowed 'General case' 0 N--CA 1.501 2.079 0 CA-C-O 121.428 0.632 . . . . 0.0 110.268 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.615 ' H ' ' C ' ' A' ' 75' ' ' ASP . . . -51.68 109.29 0.78 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.434 ' C ' ' O ' ' A' ' 77' ' ' GLY . 47.5 mt 37.63 34.59 0.05 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.83 0.824 . . . . 0.0 109.575 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -36.97 85.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.498 -0.751 . . . . 0.0 109.741 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -64.82 -35.43 81.07 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.213 -0.93 . . . . 0.0 109.186 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.499 HD22 ' NE ' ' A' ' 38' ' ' ARG . 82.4 mt -82.96 -4.41 58.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.209 -0.932 . . . . 0.0 109.257 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.468 0 CA-C-O 117.881 -1.51 . . . . 0.0 109.566 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.488 ' O ' ' N ' ' A' ' 3' ' ' VAL . 88.9 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 1' ' ' MET . 99.6 m-20 40.79 -93.57 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.636 -0.665 . . . . 0.0 110.578 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.488 ' N ' ' O ' ' A' ' 1' ' ' MET . 29.0 m -111.48 131.45 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.579 -0.7 . . . . 0.0 109.491 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.92 159.33 15.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.435 -0.791 . . . . 0.0 109.248 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.6 m170 -109.73 143.45 39.51 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.471 -0.768 . . . . 0.0 109.556 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -152.83 124.38 7.74 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.296 -0.878 . . . . 0.0 109.308 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 53.74 26.04 5.62 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.621 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.31 2.24 87.76 Favored Glycine 0 N--CA 1.495 2.619 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.94 140.58 38.73 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.35 -1.088 . . . . 0.0 109.554 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.514 -0.741 . . . . 0.0 109.41 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -124.76 130.01 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -114.98 113.29 44.19 Favored Pre-proline 0 N--CA 1.497 1.925 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.82 157.34 47.82 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.815 1.677 . . . . 0.0 112.79 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.7 -163.78 37.48 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -148.92 146.3 27.81 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.065 -1.256 . . . . 0.0 109.511 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.48 ' CD ' ' N ' ' A' ' 17' ' ' TYR . 6.5 tm0? -167.61 147.29 5.06 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.31 -0.868 . . . . 0.0 109.087 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.48 ' N ' ' CD ' ' A' ' 16' ' ' GLN . 49.5 p90 -107.63 137.86 44.9 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 85.4 mtp180 -89.04 136.04 33.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.407 -0.808 . . . . 0.0 109.929 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -71.07 -18.99 62.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.541 -0.724 . . . . 0.0 109.621 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -62.21 -45.46 93.26 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.322 -0.861 . . . . 0.0 109.744 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.11 -2.36 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 48.32 50.27 16.73 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.582 -0.699 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -139.55 157.28 46.08 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.408 -0.808 . . . . 0.0 109.07 178.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -85.73 131.66 34.29 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.626 -0.672 . . . . 0.0 109.78 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.0 148.75 36.63 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.252 -0.905 . . . . 0.0 109.344 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.74 110.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.325 2.016 . . . . 0.0 111.608 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -108.07 113.2 26.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.153 -0.967 . . . . 0.0 109.234 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.55 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -137.49 154.3 49.91 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.4 -0.813 . . . . 0.0 108.858 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 84.7 mt -109.69 129.64 55.59 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 94.6 mt -107.23 128.64 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.683 -0.636 . . . . 0.0 109.399 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -130.43 138.48 50.34 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -82.41 137.98 34.56 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.405 -0.81 . . . . 0.0 109.498 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 87.1 t -69.28 101.91 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.403 -0.811 . . . . 0.0 109.851 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 137.23 -21.65 3.28 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.412 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 15.9 m -152.04 55.12 1.45 Allowed Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.153 -1.204 . . . . 0.0 109.959 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 57.6 Cg_endo -72.28 -11.64 26.97 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.354 2.036 . . . . 0.0 111.36 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -74.87 -2.85 28.66 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.439 -0.788 . . . . 0.0 109.534 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.446 ' O ' ' C ' ' A' ' 39' ' ' THR . 24.1 mmm180 -81.18 132.65 35.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.173 -0.954 . . . . 0.0 109.197 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.446 ' C ' ' O ' ' A' ' 38' ' ' ARG . 88.6 m -33.67 97.61 0.12 Allowed Pre-proline 0 N--CA 1.5 2.047 0 O-C-N 122.113 -0.367 . . . . 0.0 110.147 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.63 143.42 68.91 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.124 1.882 . . . . 0.0 112.326 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 24.2 mm -106.01 130.76 22.48 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.313 -0.867 . . . . 0.0 108.734 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.2 148.49 39.26 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.763 1.642 . . . . 0.0 112.121 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.55 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 10.2 t -120.43 133.58 55.4 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.3 p -136.19 167.75 20.69 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -128.33 143.72 49.18 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.542 -0.724 . . . . 0.0 109.388 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -44.04 -27.36 1.75 Allowed 'Trans proline' 0 N--CA 1.493 1.492 0 C-N-CA 121.939 1.759 . . . . 0.0 112.008 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.24 165.01 14.67 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.396 -0.815 . . . . 0.0 109.917 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -128.4 148.06 50.68 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -150.61 110.88 4.17 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.084 -1.01 . . . . 0.0 109.667 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 50' ' ' ASP . 68.3 t0 -66.69 -33.58 75.95 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.692 -0.63 . . . . 0.0 109.938 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 77.0 mt -79.35 138.19 37.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.165 -0.96 . . . . 0.0 110.953 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -70.74 -36.88 73.36 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.567 0.699 . . . . 0.0 109.416 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.29 -49.26 77.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.91 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.59 -36.18 83.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.381 -0.824 . . . . 0.0 108.938 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.93 -40.25 97.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.33 -0.856 . . . . 0.0 109.563 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.16 -50.02 65.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.271 -0.893 . . . . 0.0 110.194 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -62.92 -44.57 95.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.281 -0.887 . . . . 0.0 109.647 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.28 -42.39 93.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.351 -0.843 . . . . 0.0 109.733 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.532 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 93.8 p -55.82 -40.51 72.87 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.711 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.403 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.4 mt -64.3 -45.32 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.053 -1.029 . . . . 0.0 109.457 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.31 -49.19 62.12 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.351 -0.843 . . . . 0.0 109.681 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.9 m -62.91 -34.79 78.18 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.529 -0.732 . . . . 0.0 109.436 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.8 -41.8 92.02 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.377 -0.827 . . . . 0.0 109.353 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.403 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 64.7 mttp -62.92 -44.7 95.37 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.197 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.59 -43.51 86.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.481 -0.762 . . . . 0.0 109.21 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.1 mm -62.31 -44.74 99.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.4 mt -64.55 -45.05 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.035 -1.041 . . . . 0.0 109.603 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -67.08 -51.59 52.48 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.863 . . . . 0.0 109.741 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.505 ' O ' ' N ' ' A' ' 73' ' ' ARG . 58.9 m -62.09 -41.45 98.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 109.349 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.702 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 55.7 t60 -53.19 -43.79 67.43 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.376 -0.827 . . . . 0.0 109.432 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.4 mt -62.61 -42.03 99.33 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.352 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -98.99 16.85 21.2 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.36 -0.837 . . . . 0.0 109.997 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 69' ' ' SER . 71.4 ttt180 -159.35 125.38 4.38 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.205 -0.934 . . . . 0.0 110.134 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.405 ' O ' ' O ' ' A' ' 73' ' ' ARG . 11.0 m-70 44.57 94.43 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.549 -0.72 . . . . 0.0 110.334 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -81.58 -5.37 57.95 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.256 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.406 ' O ' ' O ' ' A' ' 77' ' ' GLY . 6.8 tm0? -67.11 -35.45 79.8 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.886 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . -44.45 -97.21 0.01 OUTLIER Glycine 0 N--CA 1.493 2.452 0 O-C-N 121.358 -0.839 . . . . 0.0 111.227 -178.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.702 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 45.8 mt -73.61 37.03 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.129 -1.218 . . . . 0.0 110.21 -178.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -65.44 -35.62 81.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.362 -0.837 . . . . 0.0 109.768 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -62.57 -35.44 79.52 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.383 -0.823 . . . . 0.0 108.986 -179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.24 -2.64 53.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.409 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.584 179.734 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.408 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -149.97 19.92 0.88 Allowed 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 m -82.57 154.83 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -113.56 138.23 50.45 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.586 0.708 . . . . 0.0 109.478 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -91.67 138.91 31.18 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.524 0.678 . . . . 0.0 110.04 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -149.4 121.87 8.51 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.532 -0.73 . . . . 0.0 109.608 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 52.89 29.17 7.36 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.623 0.725 . . . . 0.0 110.382 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.97 1.37 88.83 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -105.06 139.86 39.1 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.458 -1.025 . . . . 0.0 109.895 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -87.4 139.67 30.32 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.9 mt -123.16 129.83 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 CA-C-O 121.387 0.613 . . . . 0.0 109.463 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -121.05 92.46 48.51 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.68 148.35 22.76 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.759 2.306 . . . . 0.0 112.801 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.95 161.83 29.77 Favored Glycine 0 N--CA 1.487 2.06 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -93.88 124.98 38.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.642 -0.917 . . . . 0.0 109.921 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -149.4 153.53 37.51 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.613 -0.679 . . . . 0.0 109.514 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -108.32 136.74 47.46 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.614 0.721 . . . . 0.0 109.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -96.39 138.74 33.53 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.631 0.729 . . . . 0.0 109.756 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.72 -24.59 65.39 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.542 0.687 . . . . 0.0 109.804 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -61.09 -45.1 96.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 110.335 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 16.9 pt -110.25 -5.07 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.404 -0.81 . . . . 0.0 109.313 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 49.14 42.23 20.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.658 0.742 . . . . 0.0 109.873 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -144.57 165.4 28.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 110.098 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -85.26 128.31 34.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.619 0.723 . . . . 0.0 110.043 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.7 m -146.82 148.07 31.85 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.531 -0.73 . . . . 0.0 109.192 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -40.93 110.31 0.12 Allowed 'Trans proline' 0 C--N 1.315 -1.223 0 C-N-CA 122.503 2.135 . . . . 0.0 112.091 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.415 ' OH ' HD21 ' A' ' 29' ' ' LEU . 82.1 t80 -114.59 119.87 38.24 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.722 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -138.67 145.05 39.94 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.61 -0.681 . . . . 0.0 109.259 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.415 HD21 ' OH ' ' A' ' 27' ' ' TYR . 64.4 mt -106.27 131.93 52.91 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -114.7 127.46 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 CA-C-O 121.374 0.607 . . . . 0.0 109.487 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -134.26 133.97 41.4 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.451 0.643 . . . . 0.0 109.267 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -81.97 137.63 35.1 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.643 0.735 . . . . 0.0 110.15 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.0 t -68.56 133.3 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.607 0.717 . . . . 0.0 110.192 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.413 ' O ' HG13 ' A' ' 35' ' ' VAL . . . 103.16 -22.86 35.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.413 HG13 ' O ' ' A' ' 34' ' ' GLY . 19.1 m -154.85 54.7 1.07 Allowed Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.28 -1.129 . . . . 0.0 110.32 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.41 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 58.4 Cg_endo -72.31 -12.74 27.78 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.529 2.153 . . . . 0.0 110.916 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -87.39 40.17 0.91 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.6 -0.688 . . . . 0.0 109.908 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -114.12 55.53 0.73 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.487 -0.758 . . . . 0.0 109.348 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m 43.15 82.59 0.22 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.966 -0.459 . . . . 0.0 109.775 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.59 143.66 77.96 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.77 2.313 . . . . 0.0 112.528 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.5 ' N ' HD12 ' A' ' 41' ' ' ILE . 3.7 mp -116.38 130.96 24.09 Favored Pre-proline 0 N--CA 1.491 1.593 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.51 149.01 38.54 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.469 2.113 . . . . 0.0 112.461 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.722 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.5 OUTLIER -111.09 133.01 53.79 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -134.85 162.06 33.47 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.611 0.72 . . . . 0.0 109.574 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.623 ' O ' ' N ' ' A' ' 47' ' ' GLU . 12.9 t80 -143.15 135.25 13.19 Favored Pre-proline 0 N--CA 1.487 1.416 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -43.29 76.73 0.01 OUTLIER 'Trans proline' 0 N--CA 1.499 1.797 0 C-N-CA 122.857 2.371 . . . . 0.0 112.207 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.623 ' N ' ' O ' ' A' ' 45' ' ' TYR . 71.1 mm-40 -148.91 148.39 29.78 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.481 -0.762 . . . . 0.0 109.387 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -127.31 118.91 25.1 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -140.51 131.1 25.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.636 -0.665 . . . . 0.0 109.812 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -91.35 -25.43 19.4 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -76.16 143.6 41.06 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.64 0.733 . . . . 0.0 109.972 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -73.1 -40.64 64.82 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.43 0.633 . . . . 0.0 110.176 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.05 92.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.368 -0.832 . . . . 0.0 109.853 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.11 -42.49 96.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.359 -0.838 . . . . 0.0 109.839 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.76 -43.57 88.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.387 -0.821 . . . . 0.0 109.825 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.99 -44.89 75.58 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.524 -0.735 . . . . 0.0 109.804 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -63.85 -45.56 88.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.477 -0.765 . . . . 0.0 109.725 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.13 -42.16 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.579 -0.7 . . . . 0.0 109.777 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.416 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 77.9 p -54.73 -41.62 70.58 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.442 -0.786 . . . . 0.0 109.856 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.66 -44.62 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 109.481 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.09 91.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.391 -0.818 . . . . 0.0 109.654 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 93.7 m -67.35 -46.41 73.47 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.326 -0.859 . . . . 0.0 109.701 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -49.37 -43.41 44.08 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.438 -0.789 . . . . 0.0 109.502 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.74 -42.59 97.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.577 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.3 -44.64 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.387 -0.821 . . . . 0.0 109.997 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.2 -44.59 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.489 -0.757 . . . . 0.0 109.314 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.4 mt -64.7 -44.33 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -66.15 -44.22 84.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.505 -0.747 . . . . 0.0 109.906 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.497 ' O ' ' N ' ' A' ' 73' ' ' ARG . 43.3 t -65.66 -40.36 92.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.358 -0.839 . . . . 0.0 110.1 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -59.23 -42.1 90.25 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.903 . . . . 0.0 109.673 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -62.8 -42.97 99.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.445 -0.784 . . . . 0.0 109.858 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -84.1 -19.94 33.42 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.382 -0.824 . . . . 0.0 109.584 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 69' ' ' SER . 84.8 mtt85 -141.68 93.45 2.56 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.304 -0.873 . . . . 0.0 109.364 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.445 ' O ' ' N ' ' A' ' 76' ' ' GLN . 93.6 m-70 -57.38 -44.54 84.56 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.615 -0.678 . . . . 0.0 109.214 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' HIS . 98.2 m-20 36.42 -96.75 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.677 0.751 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 74' ' ' HIS . 12.0 tp-100 -169.62 97.06 0.31 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.458 -0.776 . . . . 0.0 109.324 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -75.0 0.02 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -102.91 17.1 24.79 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.377 -1.072 . . . . 0.0 109.682 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.49 -28.3 69.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.323 -0.86 . . . . 0.0 109.335 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.456 ' HB3' HD11 ' A' ' 41' ' ' ILE . 68.0 t0 -64.16 -32.96 74.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.535 -0.728 . . . . 0.0 109.518 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.6 mt -79.59 -3.94 49.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.37 -0.831 . . . . 0.0 109.797 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.019 -1.434 . . . . 0.0 109.744 179.908 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -65.11 -39.98 93.88 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.58 0.705 . . . . 0.0 109.512 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.2 m -86.71 133.83 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.357 -0.839 . . . . 0.0 110.224 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.68 159.58 15.15 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.525 0.679 . . . . 0.0 109.775 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -111.64 152.98 27.03 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.738 0.78 . . . . 0.0 110.239 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -139.94 -134.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.671 0.748 . . . . 0.0 109.934 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -72.65 51.99 0.28 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.754 0.788 . . . . 0.0 110.067 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.87 -6.86 82.64 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -105.99 138.7 41.72 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.339 -1.095 . . . . 0.0 110.34 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -85.6 144.7 27.73 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.359 0.599 . . . . 0.0 109.498 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.9 mt -125.32 132.1 71.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 121.5 0.667 . . . . 0.0 109.877 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -126.03 124.29 24.63 Favored Pre-proline 0 N--CA 1.49 1.559 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.1 157.18 38.25 Favored 'Trans proline' 0 N--CA 1.494 1.528 0 C-N-CA 122.608 2.205 . . . . 0.0 112.729 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.69 -169.32 42.26 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.509 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 47.4 p-80 -148.76 146.85 28.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.768 -0.842 . . . . 0.0 109.767 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -169.78 151.35 4.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -109.3 142.95 39.45 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 121.887 0.851 . . . . 0.0 110.261 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -94.58 136.23 35.12 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.869 0.843 . . . . 0.0 109.477 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 42.3 p30 -68.0 -20.0 64.98 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 121.424 0.631 . . . . 0.0 109.673 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.522 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 98.9 m-20 -62.38 -42.16 99.2 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.5 -0.75 . . . . 0.0 109.639 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 39.2 pt -115.56 -3.13 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.573 -0.704 . . . . 0.0 109.281 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm-85 49.16 40.54 17.92 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.632 -0.667 . . . . 0.0 109.988 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.2 mmtt -135.83 161.16 36.39 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.651 0.739 . . . . 0.0 110.38 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -86.44 128.33 34.94 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 121.574 0.702 . . . . 0.0 109.85 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -137.3 147.6 58.8 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -38.97 108.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.248 0 C-N-CA 122.631 2.221 . . . . 0.0 112.057 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -106.33 116.97 32.85 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.487 0.66 . . . . 0.0 109.645 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.733 ' HB3' HG23 ' A' ' 43' ' ' THR . . . -135.11 141.78 46.08 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.681 0.753 . . . . 0.0 109.079 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.2 mt -105.08 127.08 52.72 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.65 0.738 . . . . 0.0 109.309 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.7 mt -115.16 130.46 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.458 0.647 . . . . 0.0 109.465 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -129.96 134.85 47.72 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.912 0.863 . . . . 0.0 109.672 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -82.6 137.33 34.56 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 121.872 0.844 . . . . 0.0 110.202 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.9 t -69.13 132.64 32.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.676 0.751 . . . . 0.0 110.199 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 105.89 -25.11 25.01 Favored Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -152.73 66.89 6.41 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.384 -1.068 . . . . 0.0 109.852 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.4 ' O ' ' O ' ' A' ' 37' ' ' ASP . 36.8 Cg_exo -57.24 -35.08 98.84 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.41 2.073 . . . . 0.0 111.028 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.574 ' C ' ' H ' ' A' ' 39' ' ' THR . 82.8 m-20 -61.05 -127.63 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.41 0.624 . . . . 0.0 110.228 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.534 ' NE ' ' O ' ' A' ' 80' ' ' ASP . 83.3 mtp180 57.33 2.2 0.13 Allowed 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.567 0.699 . . . . 0.0 109.521 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.574 ' H ' ' C ' ' A' ' 37' ' ' ASP . 1.3 m 77.55 101.65 0.03 OUTLIER Pre-proline 0 C--N 1.293 -1.877 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.64 145.53 29.86 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.18 1.92 . . . . 0.0 112.427 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 34.9 mm -114.82 95.39 41.04 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.17 142.94 43.91 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.7 2.267 . . . . 0.0 112.447 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.733 HG23 ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -107.74 138.38 44.09 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.692 0.758 . . . . 0.0 110.102 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.2 p -139.24 166.65 23.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.497 0.665 . . . . 0.0 109.48 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.59 ' O ' ' N ' ' A' ' 47' ' ' GLU . 39.9 t80 -137.66 138.29 23.9 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.33 72.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.776 0 C-N-CA 122.863 2.375 . . . . 0.0 112.337 178.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.59 ' N ' ' O ' ' A' ' 45' ' ' TYR . 17.3 pt-20 -173.06 143.45 1.15 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.393 -0.817 . . . . 0.0 109.313 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -125.2 149.61 47.78 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.678 0.752 . . . . 0.0 109.832 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -137.77 131.3 31.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.609 0.719 . . . . 0.0 109.6 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -74.1 -16.4 61.02 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 81.4 mt -96.6 130.56 43.77 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.791 0.805 . . . . 0.0 109.443 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.509 ' OE2' ' CE1' ' A' ' 15' ' ' HIS . 83.3 tt0 -69.02 -37.36 78.6 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 121.262 0.553 . . . . 0.0 110.397 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.99 -42.84 95.1 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.188 -0.945 . . . . 0.0 109.649 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.96 -39.84 95.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.538 -0.726 . . . . 0.0 109.432 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.79 -40.02 94.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.531 -0.731 . . . . 0.0 109.788 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.05 -48.43 68.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.441 -0.787 . . . . 0.0 110.016 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 72.8 ttp85 -64.11 -44.55 91.92 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 121.766 0.793 . . . . 0.0 109.767 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.37 -41.9 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.579 -0.7 . . . . 0.0 109.659 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.656 ' HB2' ' HB2' ' A' ' 28' ' ' ALA . 78.3 p -57.9 -40.15 79.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.46 -0.775 . . . . 0.0 109.681 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.17 -44.17 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 109.244 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.72 82.55 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.68 0.752 . . . . 0.0 109.405 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.512 ' SG ' ' N ' ' A' ' 63' ' ' ALA . 1.2 p -66.13 -36.96 84.51 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.821 0.82 . . . . 0.0 109.373 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.512 ' N ' ' SG ' ' A' ' 62' ' ' CYS . . . -60.89 -44.83 96.58 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.528 0.68 . . . . 0.0 109.473 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.96 -42.51 97.26 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.607 0.718 . . . . 0.0 109.513 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.48 -43.18 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.555 -0.716 . . . . 0.0 109.736 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.78 -43.22 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.353 -0.842 . . . . 0.0 109.652 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.4 -44.12 98.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.576 -0.703 . . . . 0.0 109.432 -179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -67.8 -40.54 83.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.358 -0.838 . . . . 0.0 109.314 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 73' ' ' ARG . 66.8 m -63.43 -42.22 98.7 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.619 -0.675 . . . . 0.0 110.098 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.75 -47.34 85.64 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.251 -0.905 . . . . 0.0 109.811 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.95 -41.45 95.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.523 -0.736 . . . . 0.0 109.412 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -90.83 -77.13 0.42 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 109.967 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 69' ' ' SER . 60.9 ttm-85 -65.0 -106.57 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.607 -0.683 . . . . 0.0 110.176 -179.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.667 ' CE1' ' H ' ' A' ' 76' ' ' GLN . 47.6 t-80 -178.97 -100.47 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 121.504 0.669 . . . . 0.0 109.197 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.579 ' N ' ' ND1' ' A' ' 74' ' ' HIS . 99.6 m-20 55.33 33.13 20.11 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-O 121.744 0.783 . . . . 0.0 109.378 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.667 ' H ' ' CE1' ' A' ' 74' ' ' HIS . 43.1 tt0 46.16 -128.15 1.37 Allowed 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.765 0.793 . . . . 0.0 110.024 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.523 ' C ' ' H ' ' A' ' 79' ' ' ALA . . . 59.1 139.85 0.01 OUTLIER Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 30.2 mt 60.65 0.0 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.712 0.768 . . . . 0.0 109.244 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.523 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -64.44 -39.71 94.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.481 -0.762 . . . . 0.0 109.458 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.534 ' O ' ' NE ' ' A' ' 38' ' ' ARG . 97.6 m-20 -69.87 -19.48 63.43 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.491 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 78.1 mt -94.38 1.29 55.86 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.459 ' N ' ' NH2' ' A' ' 38' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.553 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ttt . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -78.52 -78.26 0.15 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.536 -0.727 . . . . 0.0 109.538 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m -85.89 155.05 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.677 0.751 . . . . 0.0 110.379 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.75 135.14 54.96 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.879 0.847 . . . . 0.0 109.965 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -88.14 136.79 32.81 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.726 0.774 . . . . 0.0 110.035 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -149.8 125.02 10.1 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.748 0.785 . . . . 0.0 109.569 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.539 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 23.6 mmt85 54.18 25.8 6.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.42 0.628 . . . . 0.0 109.867 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.72 3.62 83.43 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -107.63 141.24 39.41 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-O 121.859 0.837 . . . . 0.0 110.307 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -85.6 144.85 27.64 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.8 mt -124.0 129.4 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.714 0.769 . . . . 0.0 110.013 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -129.61 96.54 26.76 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.41 159.63 32.57 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.956 2.438 . . . . 0.0 113.118 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.32 126.86 0.94 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.629 ' NE2' ' CD2' ' A' ' 24' ' ' TYR . 0.3 OUTLIER -67.81 140.74 56.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.639 -0.918 . . . . 0.0 109.987 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.596 ' N ' ' ND1' ' A' ' 15' ' ' HIS . 58.6 tt0 -165.18 150.96 9.68 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 121.815 0.817 . . . . 0.0 109.753 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.55 137.67 40.48 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.793 0.806 . . . . 0.0 109.79 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp85 -97.64 135.73 39.03 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.902 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.0 p-10 -71.86 -18.06 62.09 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.93 -42.29 97.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.699 -0.626 . . . . 0.0 109.436 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 38.9 pt -113.57 -7.59 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 51.32 51.3 17.16 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.493 0.663 . . . . 0.0 109.608 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -146.48 169.67 18.43 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 121.932 0.872 . . . . 0.0 110.397 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.629 ' CD2' ' NE2' ' A' ' 15' ' ' HIS . 3.2 m-85 -86.51 124.23 32.6 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.746 0.784 . . . . 0.0 109.314 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.45 155.45 39.18 Favored Pre-proline 0 C--N 1.302 -1.464 0 CA-C-O 121.241 0.544 . . . . 0.0 109.713 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.4 ' CB ' ' OG ' ' A' ' 59' ' ' SER . 19.4 Cg_endo -59.33 136.66 73.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.414 2.076 . . . . 0.0 111.726 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -138.52 116.87 11.94 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.409 0.623 . . . . 0.0 109.39 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -133.52 153.99 51.19 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.727 0.775 . . . . 0.0 110.206 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.8 mt -107.94 131.18 54.81 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.732 0.777 . . . . 0.0 109.845 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 89.3 mt -108.85 128.01 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 CA-C-O 121.716 0.77 . . . . 0.0 109.446 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -135.67 134.96 39.73 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.734 0.778 . . . . 0.0 109.836 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -86.83 134.87 33.51 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.751 0.786 . . . . 0.0 109.994 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 78.7 t -66.47 133.94 30.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-O 121.749 0.785 . . . . 0.0 110.503 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.68 17.82 61.17 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.9 t -146.41 64.38 9.56 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.617 -0.931 . . . . 0.0 109.805 179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.41 ' O ' ' C ' ' A' ' 37' ' ' ASP . 70.5 Cg_endo -78.75 -170.91 1.09 Allowed 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.868 2.378 . . . . 0.0 112.423 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 36' ' ' PRO . 65.5 t0 37.56 89.34 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.656 0.741 . . . . 0.0 110.569 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.878 ' H ' ' HE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -167.3 -174.37 2.56 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 121.712 0.768 . . . . 0.0 110.009 -179.807 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.5 m -82.62 130.2 59.51 Favored Pre-proline 0 N--CA 1.483 1.179 0 O-C-N 121.885 -0.51 . . . . 0.0 109.628 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.24 133.4 21.06 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 122.445 2.096 . . . . 0.0 112.349 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 35.5 mm -115.9 84.48 13.25 Favored Pre-proline 0 N--CA 1.495 1.803 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -70.32 144.57 51.45 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 122.539 2.159 . . . . 0.0 112.55 -179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.7 t -105.39 135.27 47.08 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.902 0.858 . . . . 0.0 109.757 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 166.73 22.37 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.701 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.456 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.1 OUTLIER -126.03 146.93 57.4 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -70.62 -12.08 30.71 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 122.628 2.218 . . . . 0.0 111.513 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -78.01 -178.1 5.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.607 -0.683 . . . . 0.0 110.021 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -130.44 147.58 52.16 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-O 121.903 0.859 . . . . 0.0 109.984 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -149.34 98.24 2.77 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.615 0.722 . . . . 0.0 109.559 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -71.26 -17.3 62.49 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 75.1 mt -91.27 132.34 36.2 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.807 0.813 . . . . 0.0 109.754 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -67.83 -39.51 83.89 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.8 75.78 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.683 -0.636 . . . . 0.0 109.927 -179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.84 -38.67 91.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.536 -0.728 . . . . 0.0 109.236 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.92 98.17 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.754 -0.591 . . . . 0.0 109.419 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -68.14 -47.09 69.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.747 -0.596 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -64.51 -44.05 92.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.604 -0.685 . . . . 0.0 109.665 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.434 HG12 ' SG ' ' A' ' 62' ' ' CYS . 69.7 t -67.76 -40.74 84.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.682 -0.636 . . . . 0.0 109.344 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.4 ' OG ' ' CB ' ' A' ' 26' ' ' PRO . 64.1 m -54.47 -44.81 72.92 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.543 -0.723 . . . . 0.0 109.684 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.596 -0.69 . . . . 0.0 109.375 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.19 95.02 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.767 -0.583 . . . . 0.0 109.757 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.456 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 86.5 m -67.6 -49.4 63.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.515 -0.741 . . . . 0.0 109.602 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.38 15.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.642 -0.661 . . . . 0.0 109.585 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -65.23 -41.22 94.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.735 -0.603 . . . . 0.0 109.445 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.52 -43.75 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.619 -0.676 . . . . 0.0 109.948 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.03 -44.63 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.99 -44.54 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.602 -0.687 . . . . 0.0 109.449 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.539 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 93.0 m-20 -66.32 -43.73 85.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.473 -0.767 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 73' ' ' ARG . 76.3 p -65.78 -37.46 86.38 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.721 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 84.9 t60 -58.48 -40.71 83.49 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.2 mt -63.84 -41.44 97.82 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.735 -0.603 . . . . 0.0 109.422 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -102.14 -72.7 0.68 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.652 -0.655 . . . . 0.0 109.742 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 69' ' ' SER . 83.8 mtp180 -87.58 -157.16 0.38 Allowed 'General case' 0 N--CA 1.497 1.904 0 CA-C-O 121.673 0.749 . . . . 0.0 110.446 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.412 ' C ' ' O ' ' A' ' 73' ' ' ARG . 59.3 t-80 38.43 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.565 0.698 . . . . 0.0 110.197 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' GLN . 83.6 m-20 -70.31 142.37 52.23 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.57 0.7 . . . . 0.0 109.523 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.425 ' O ' ' O ' ' A' ' 75' ' ' ASP . 50.2 tt0 57.83 152.09 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.504 0 CA-C-O 121.797 0.808 . . . . 0.0 110.395 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 151.54 -65.6 0.36 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.721 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 86.6 mt -95.83 12.1 31.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.339 -1.095 . . . . 0.0 108.801 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.73 -39.58 94.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.775 -0.578 . . . . 0.0 109.49 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -65.38 -35.72 81.82 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.477 -0.764 . . . . 0.0 109.0 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 87.2 mt -86.22 -5.2 59.24 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.806 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 -179.687 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -116.12 47.75 1.35 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.567 -0.708 . . . . 0.0 109.188 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.17 136.79 24.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.371 -0.83 . . . . 0.0 109.621 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.89 163.71 13.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.109 -0.995 . . . . 0.0 109.528 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -118.65 144.47 46.15 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.677 -0.64 . . . . 0.0 109.471 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -153.04 119.85 5.71 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.276 -0.89 . . . . 0.0 109.713 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 52.28 31.06 8.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.468 -0.77 . . . . 0.0 110.151 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.67 3.32 83.84 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 120.142 -1.028 . . . . 0.0 110.663 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -106.26 136.26 46.3 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.238 -1.154 . . . . 0.0 109.52 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -91.17 145.64 24.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.273 -0.892 . . . . 0.0 108.984 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.1 mt -118.72 128.64 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.684 -0.635 . . . . 0.0 109.709 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -123.8 94.16 46.32 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.08 162.14 32.01 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.868 1.712 . . . . 0.0 112.76 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.533 ' O ' ' ND1' ' A' ' 15' ' ' HIS . . . 179.5 -25.1 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.533 ' ND1' ' O ' ' A' ' 14' ' ' GLY . 0.1 OUTLIER 74.22 155.4 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.532 -0.981 . . . . 0.0 109.723 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -170.44 155.93 5.32 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -105.64 137.12 44.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.362 -0.836 . . . . 0.0 108.788 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -94.26 136.04 34.99 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.149 -0.97 . . . . 0.0 109.722 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' A' ' 20' ' ' ASP . 39.8 p30 -68.77 -20.69 64.36 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.478 -0.764 . . . . 0.0 109.552 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.528 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 30.4 t70 -59.29 -49.41 77.96 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.076 -1.015 . . . . 0.0 109.234 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.4 pt -105.71 -4.07 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.453 -0.78 . . . . 0.0 109.571 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 49.0 49.05 20.05 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.69 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -145.6 165.99 27.05 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.299 -0.876 . . . . 0.0 109.593 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -88.54 127.19 35.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.54 -0.725 . . . . 0.0 109.462 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.93 153.31 49.64 Favored Pre-proline 0 N--CA 1.492 1.66 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -43.45 130.97 6.99 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 121.537 1.491 . . . . 0.0 112.096 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -150.99 113.92 4.75 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' O ' HG22 ' A' ' 43' ' ' THR . . . -141.0 163.57 32.61 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.35 -0.844 . . . . 0.0 109.668 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.0 mt -106.26 131.42 53.51 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -115.94 132.26 65.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.618 -0.677 . . . . 0.0 109.89 -179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -126.02 136.96 53.57 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -96.81 124.38 40.77 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 74.1 t -65.87 -42.17 91.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.484 -0.76 . . . . 0.0 109.79 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -42.98 -49.52 6.25 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 -178.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.48 ' O ' ' O ' ' A' ' 36' ' ' PRO . 7.4 m -97.32 152.27 38.15 Favored Pre-proline 0 N--CA 1.5 2.051 0 O-C-N 120.946 -1.326 . . . . 0.0 109.638 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' VAL . 81.0 Cg_exo -47.38 -164.88 0.0 OUTLIER 'Trans proline' 0 N--CA 1.5 1.874 0 C-N-CA 122.608 2.205 . . . . 0.0 113.434 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -80.77 98.46 7.79 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.391 -0.818 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -105.13 157.36 17.31 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.474 -0.766 . . . . 0.0 109.096 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 29.1 m -44.84 133.84 5.02 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.414 -0.803 . . . . 0.0 109.409 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.02 148.3 44.76 Favored 'Trans proline' 0 C--N 1.314 -1.245 0 C-N-CA 121.391 1.394 . . . . 0.0 111.296 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.4 mm -114.02 132.82 22.5 Favored Pre-proline 0 N--CA 1.498 1.935 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -74.4 150.21 40.95 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 121.752 1.635 . . . . 0.0 112.491 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -128.07 131.63 49.07 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.476 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.0 p -136.55 164.86 27.19 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.632 -0.668 . . . . 0.0 109.422 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 47' ' ' GLU . 77.7 t80 -138.12 121.63 11.39 Favored Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -43.15 82.96 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.196 1.931 . . . . 0.0 113.288 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 45' ' ' TYR . 47.3 tp10 -168.56 151.57 5.37 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.02 148.56 30.59 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.091 -1.005 . . . . 0.0 111.574 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.47 ' CD1' ' OD2' ' A' ' 54' ' ' ASP . 66.7 m-85 -157.05 104.76 2.1 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 25.6 p-10 -74.72 -6.39 48.53 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.177 -0.952 . . . . 0.0 110.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 84.3 mt -102.74 130.32 49.66 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.053 -1.03 . . . . 0.0 110.23 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -66.35 -40.25 89.69 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.472 -0.768 . . . . 0.0 109.279 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.79 -50.88 71.0 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.049 -1.032 . . . . 0.0 109.47 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.47 ' OD2' ' CD1' ' A' ' 49' ' ' TYR . 67.7 t0 -65.47 -39.2 91.7 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.12 -0.988 . . . . 0.0 109.232 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.59 98.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.311 -0.868 . . . . 0.0 109.818 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.31 -43.81 85.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.05 -1.031 . . . . 0.0 109.315 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.9 tpp85 -62.53 -46.66 87.39 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.274 -0.891 . . . . 0.0 109.192 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.4 HG23 ' OD1' ' A' ' 54' ' ' ASP . 71.1 t -66.8 -42.62 89.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.565 -0.71 . . . . 0.0 109.781 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -56.01 -41.48 74.98 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.112 -0.993 . . . . 0.0 109.696 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.97 -44.66 97.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 O-C-N 121.134 -0.979 . . . . 0.0 109.238 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.9 -41.58 82.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.8 m -67.37 -39.79 85.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.302 -0.874 . . . . 0.0 109.786 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.94 -44.84 82.92 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.342 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -63.87 -42.1 97.6 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.144 -0.973 . . . . 0.0 109.737 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.1 mt -64.06 -43.56 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.175 -0.953 . . . . 0.0 109.629 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' A' ' 66' ' ' ILE . 30.1 mm -63.29 -43.14 98.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.295 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.87 -44.82 99.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 121.173 -0.955 . . . . 0.0 109.4 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -65.78 -45.91 80.69 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.122 -0.986 . . . . 0.0 109.15 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.5 m -62.19 -39.02 91.33 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.428 -0.795 . . . . 0.0 109.75 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.406 ' CE1' ' N ' ' A' ' 79' ' ' ALA . 86.4 t60 -58.93 -50.16 75.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.121 -0.987 . . . . 0.0 110.219 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.52 -43.23 94.69 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.086 -1.009 . . . . 0.0 109.329 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -66.42 -42.63 87.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.224 -0.922 . . . . 0.0 110.12 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.48 ' O ' ' CB ' ' A' ' 74' ' ' HIS . 33.9 ptt-85 -161.77 -155.11 0.37 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.223 -0.923 . . . . 0.0 109.923 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.48 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 11.8 t-80 81.35 136.3 0.06 Allowed 'General case' 0 N--CA 1.498 1.963 0 CA-C-O 121.231 0.538 . . . . 0.0 109.79 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -86.5 -76.27 0.36 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.443 -0.786 . . . . 0.0 109.521 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.33 -109.31 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.286 -0.884 . . . . 0.0 109.16 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.32 -126.44 40.05 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 mt -94.32 31.79 1.66 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.382 -1.069 . . . . 0.0 109.496 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.406 ' N ' ' CE1' ' A' ' 70' ' ' HIS . . . -61.57 -36.2 79.95 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.417 -0.802 . . . . 0.0 109.748 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.87 -38.15 87.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.119 -0.988 . . . . 0.0 109.401 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.1 mt -83.23 -2.95 56.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.155 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 CA-C-O 117.989 -1.451 . . . . 0.0 109.549 179.994 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.2 mtp . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 58.79 34.51 23.77 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 19.5 m -89.96 154.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.92 0.867 . . . . 0.0 110.755 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.06 134.19 55.06 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.855 0.836 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -81.97 146.91 29.5 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.701 0.763 . . . . 0.0 110.373 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.64 ' CE2' ' NH1' ' A' ' 7' ' ' ARG . 15.8 t80 -154.32 113.95 3.78 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.582 0.706 . . . . 0.0 109.423 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.64 ' NH1' ' CE2' ' A' ' 6' ' ' TYR . 83.8 mtt85 46.57 36.1 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.684 0.754 . . . . 0.0 110.184 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.11 -20.08 38.78 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 6' ' ' TYR . 93.4 m-85 -86.76 137.37 32.49 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.379 -1.071 . . . . 0.0 110.122 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -91.99 149.23 21.65 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.466 0.65 . . . . 0.0 109.312 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 90.7 mt -122.82 132.26 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 CA-C-O 121.724 0.773 . . . . 0.0 109.435 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -120.62 88.49 43.35 Favored Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.87 147.37 81.77 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 C-N-CA 122.66 2.24 . . . . 0.0 112.375 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.59 -173.72 35.22 Favored Glycine 0 N--CA 1.486 2.032 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.507 ' CD2' ' OE2' ' A' ' 52' ' ' GLU . 53.7 p-80 -141.08 122.53 15.0 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.759 0.79 . . . . 0.0 109.964 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -154.6 155.33 34.53 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.907 0.86 . . . . 0.0 110.129 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -110.53 145.94 36.88 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.683 0.754 . . . . 0.0 110.071 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.733 ' HE ' HG21 ' A' ' 44' ' ' THR . 95.0 mtt-85 -101.32 137.67 39.35 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.703 0.763 . . . . 0.0 109.756 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -68.46 -15.27 63.49 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.717 -0.614 . . . . 0.0 109.95 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -62.83 -43.26 99.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.375 -0.828 . . . . 0.0 109.362 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.8 pt -114.96 -7.92 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.1 mmm180 55.17 44.11 28.31 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 121.433 0.635 . . . . 0.0 110.09 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -141.3 161.08 38.74 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.616 0.722 . . . . 0.0 110.49 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.96 128.67 34.73 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.947 0.879 . . . . 0.0 109.85 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.7 m -140.19 149.18 57.27 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -37.04 108.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.315 -1.196 0 C-N-CA 122.939 2.426 . . . . 0.0 112.387 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -104.78 119.89 40.07 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.669 0.747 . . . . 0.0 109.957 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.485 ' HB3' ' CG2' ' A' ' 43' ' ' THR . . . -144.86 147.64 33.04 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.835 0.826 . . . . 0.0 109.577 179.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.8 mt -109.62 133.83 52.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.621 0.724 . . . . 0.0 109.199 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 mm -103.18 123.05 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.453 HH22 ' C ' ' A' ' 36' ' ' PRO . 20.8 mmm180 -127.94 137.31 52.22 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.9 0.857 . . . . 0.0 110.22 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -101.89 141.56 34.56 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.899 0.857 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 81.8 t -60.78 132.73 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-O 121.952 0.882 . . . . 0.0 110.637 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 80.15 20.36 67.53 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.401 ' O ' ' O ' ' A' ' 36' ' ' PRO . 23.0 t -133.06 82.38 54.64 Favored Pre-proline 0 N--CA 1.502 2.145 0 O-C-N 121.308 -1.113 . . . . 0.0 109.665 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.453 ' C ' HH22 ' A' ' 31' ' ' ARG . 51.5 Cg_exo -53.07 -160.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.707 2.272 . . . . 0.0 112.468 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -52.45 110.84 0.54 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.611 0.72 . . . . 0.0 110.108 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 mmm180 -137.99 62.28 1.57 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 121.563 0.697 . . . . 0.0 109.426 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 m 50.64 79.66 0.33 Allowed Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -57.92 145.34 91.56 Favored 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.487 2.125 . . . . 0.0 112.515 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.543 ' N ' HD12 ' A' ' 41' ' ' ILE . 0.9 OUTLIER -127.32 89.26 51.99 Favored Pre-proline 0 N--CA 1.493 1.676 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.788 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.39 143.05 56.08 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.702 2.268 . . . . 0.0 112.833 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.485 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 14.8 t -105.32 134.83 47.77 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.821 0.819 . . . . 0.0 109.831 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.733 HG21 ' HE ' ' A' ' 18' ' ' ARG . 47.0 p -141.2 167.26 22.61 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.54 0.686 . . . . 0.0 109.871 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.578 ' CD1' ' SG ' ' A' ' 62' ' ' CYS . 0.5 OUTLIER -128.44 146.49 60.07 Favored Pre-proline 0 N--CA 1.486 1.367 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -48.99 -37.18 36.71 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 122.058 1.839 . . . . 0.0 111.271 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -45.55 150.55 0.48 Allowed 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.798 0.808 . . . . 0.0 110.15 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -121.85 139.6 53.42 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-O 121.822 0.82 . . . . 0.0 110.045 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.417 ' CE2' HG21 ' A' ' 58' ' ' VAL . 67.7 m-85 -141.66 111.93 6.92 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.686 0.755 . . . . 0.0 109.341 179.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.49 ' OD1' ' N ' ' A' ' 50' ' ' ASP . 20.1 p-10 -68.32 -33.08 73.66 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.76 136.68 39.02 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.014 0.911 . . . . 0.0 109.942 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.507 ' OE2' ' CD2' ' A' ' 15' ' ' HIS . 43.6 tt0 -70.71 -37.07 73.52 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.765 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.71 -39.19 93.28 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.556 -0.715 . . . . 0.0 110.326 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -65.16 -38.97 92.25 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.45 -0.781 . . . . 0.0 109.362 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -37.91 89.19 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.614 -0.679 . . . . 0.0 109.819 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -66.85 -47.64 71.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.472 -0.768 . . . . 0.0 109.768 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -66.17 -44.1 85.03 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 121.47 0.652 . . . . 0.0 109.865 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.417 HG21 ' CE2' ' A' ' 49' ' ' TYR . 75.5 t -66.98 -41.28 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 109.575 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.0 p -57.87 -39.47 77.87 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.573 -0.704 . . . . 0.0 109.715 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.0 -45.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.62 -39.18 77.34 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.497 0.665 . . . . 0.0 109.764 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.578 ' SG ' ' CD1' ' A' ' 45' ' ' TYR . 5.9 t -70.92 -37.36 72.9 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.478 -0.764 . . . . 0.0 109.662 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.86 87.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.69 -0.631 . . . . 0.0 109.711 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -64.02 -42.93 96.96 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.563 0.697 . . . . 0.0 109.293 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 97.3 mt -65.36 -43.51 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.647 -0.658 . . . . 0.0 109.642 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -64.22 -44.18 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 110.104 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.2 mt -65.1 -43.68 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.642 -0.661 . . . . 0.0 109.306 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -66.24 -43.65 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.628 -0.67 . . . . 0.0 109.456 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.0 p -68.27 -36.66 79.74 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.56 0.695 . . . . 0.0 109.435 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.453 ' ND1' ' OD1' ' A' ' 75' ' ' ASP . 84.3 t60 -61.27 -45.29 95.1 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.628 -0.67 . . . . 0.0 109.76 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 81.3 mt -64.65 -42.91 95.09 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.468 0.651 . . . . 0.0 109.639 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -75.55 -17.87 59.94 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -151.38 106.6 3.31 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -72.97 105.67 4.55 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.852 0.834 . . . . 0.0 109.551 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.453 ' OD1' ' ND1' ' A' ' 70' ' ' HIS . 39.6 p-10 -96.94 9.0 43.22 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 67.26 8.57 6.32 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.816 0.817 . . . . 0.0 109.256 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.68 -37.83 89.43 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.98 25.96 10.72 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.716 -0.873 . . . . 0.0 109.64 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.12 79.55 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.353 -0.842 . . . . 0.0 109.426 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.466 ' HB2' HD11 ' A' ' 41' ' ' ILE . 99.7 m-20 -62.5 -40.81 97.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.445 0.64 . . . . 0.0 109.64 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.4 mt -84.84 -2.56 57.91 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -179.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.537 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.7 mtm . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -82.11 144.68 30.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.46 -0.775 . . . . 0.0 109.812 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.6 m -108.63 131.02 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-O 121.839 0.828 . . . . 0.0 110.108 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.44 155.34 17.92 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.546 -0.721 . . . . 0.0 109.509 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -109.52 141.39 42.05 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.71 0.767 . . . . 0.0 109.947 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -153.69 122.59 6.41 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.41 -0.806 . . . . 0.0 109.21 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 54.83 25.91 7.17 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.634 0.73 . . . . 0.0 110.083 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 86.48 8.37 77.55 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -110.84 142.94 42.18 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.349 -1.089 . . . . 0.0 110.292 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -91.91 142.34 27.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.407 -0.808 . . . . 0.0 109.438 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -123.13 130.62 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.511 -0.743 . . . . 0.0 109.591 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -120.83 94.22 48.87 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -78.26 148.6 24.2 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 122.608 2.205 . . . . 0.0 113.101 -178.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.78 115.04 0.39 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -55.18 136.91 48.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -1.038 . . . . 0.0 111.034 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -153.59 149.29 27.46 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.467 -0.771 . . . . 0.0 109.32 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -106.78 134.32 50.11 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.858 0.837 . . . . 0.0 110.119 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 94.2 mtt180 -94.13 138.19 32.47 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.538 -0.726 . . . . 0.0 109.786 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -68.66 -20.74 64.47 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.531 -0.731 . . . . 0.0 109.434 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.83 -43.68 95.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.904 . . . . 0.0 109.784 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 15.1 pt -112.12 -0.31 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' ARG . 90.2 mtm-85 43.28 37.2 1.22 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.64 -0.662 . . . . 0.0 110.401 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -137.48 162.56 33.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.253 -0.905 . . . . 0.0 110.172 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -86.12 128.57 34.9 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.843 0.83 . . . . 0.0 109.85 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 34.5 m -145.84 147.63 33.16 Favored Pre-proline 0 N--CA 1.491 1.586 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -37.27 110.29 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 C-N-CA 122.707 2.272 . . . . 0.0 112.17 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -119.58 118.42 30.96 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.38 -0.825 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -143.1 155.0 44.5 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.312 -0.868 . . . . 0.0 109.179 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -111.08 130.28 55.66 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.731 . . . . 0.0 109.254 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 98.1 mt -107.11 130.65 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -134.81 138.51 44.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.501 -0.75 . . . . 0.0 109.048 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.53 137.48 32.3 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.4 -0.812 . . . . 0.0 110.196 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 76.7 t -70.11 133.61 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.692 0.758 . . . . 0.0 110.39 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.34 -30.12 10.72 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.534 HG23 ' NH2' ' A' ' 38' ' ' ARG . 2.3 m -148.59 52.12 1.13 Allowed Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.157 -1.202 . . . . 0.0 109.638 179.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.447 ' CD ' ' N ' ' A' ' 35' ' ' VAL . 72.9 Cg_endo -76.29 -10.74 19.21 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.509 2.139 . . . . 0.0 110.591 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 51.9 p-10 -91.03 54.85 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.46 -0.775 . . . . 0.0 109.689 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.58 ' NH2' ' O ' ' A' ' 81' ' ' LEU . 70.0 mtm180 -119.27 -107.24 0.37 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.447 -0.783 . . . . 0.0 110.023 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.6 m -135.09 86.91 30.38 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.495 -0.753 . . . . 0.0 109.052 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -55.19 140.46 81.08 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.763 2.309 . . . . 0.0 112.035 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.88 131.05 24.04 Favored Pre-proline 0 N--CA 1.495 1.777 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.81 142.78 44.11 Favored 'Trans proline' 0 N--CA 1.491 1.324 0 C-N-CA 122.132 1.888 . . . . 0.0 112.494 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.8 t -119.22 130.22 55.36 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.642 0.734 . . . . 0.0 109.089 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -139.22 167.45 22.05 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.553 ' O ' ' N ' ' A' ' 47' ' ' GLU . 82.6 t80 -120.62 123.8 27.89 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.596 -0.69 . . . . 0.0 109.193 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -43.35 80.54 0.01 OUTLIER 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 122.576 2.184 . . . . 0.0 112.561 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 45' ' ' TYR . 81.2 tt0 -172.69 157.76 3.88 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.266 -0.896 . . . . 0.0 109.028 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -112.09 140.08 47.07 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.361 -0.837 . . . . 0.0 109.486 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.475 ' CZ ' ' OE2' ' A' ' 47' ' ' GLU . 37.7 m-85 -135.7 131.56 35.79 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.38 -0.825 . . . . 0.0 108.9 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -93.32 -23.95 18.3 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.83 137.76 32.03 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.068 -1.02 . . . . 0.0 110.181 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -71.13 -37.51 72.3 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.48 -0.762 . . . . 0.0 109.398 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.49 84.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 109.421 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.7 -41.46 98.12 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.405 -0.81 . . . . 0.0 109.506 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.2 96.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 109.981 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -69.85 -44.25 70.24 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.118 -0.989 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -67.68 -43.01 81.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.162 -0.961 . . . . 0.0 110.027 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.92 -42.68 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.709 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 79.4 p -60.35 -42.15 95.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.623 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 93.7 mt -65.52 -44.47 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.147 -0.971 . . . . 0.0 109.691 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.71 -39.3 80.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.053 -1.03 . . . . 0.0 109.211 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 10.8 t -69.54 -38.37 77.48 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.406 -0.809 . . . . 0.0 109.625 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.9 -46.13 85.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.806 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.48 -43.82 96.21 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.118 -0.989 . . . . 0.0 109.455 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.57 -43.06 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.908 . . . . 0.0 109.394 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.44 -44.05 98.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.177 -0.952 . . . . 0.0 109.586 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.02 -44.48 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.216 -0.928 . . . . 0.0 109.447 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -66.4 -41.98 88.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.431 -0.793 . . . . 0.0 109.878 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.8 p -67.63 -35.73 79.47 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.237 -0.914 . . . . 0.0 109.692 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.649 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 80.9 t60 -60.64 -43.86 97.08 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.334 -0.854 . . . . 0.0 109.61 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.87 -41.78 97.69 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.863 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -83.48 -77.22 0.26 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.17 -0.956 . . . . 0.0 110.24 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 74' ' ' HIS . 53.4 ttp180 -109.38 -123.78 0.26 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.342 -0.849 . . . . 0.0 109.945 -179.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.415 ' C ' ' O ' ' A' ' 73' ' ' ARG . 15.1 m80 36.69 87.26 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.025 0.917 . . . . 0.0 110.341 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 76' ' ' GLN . 55.3 t0 -71.79 147.82 46.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.432 -0.792 . . . . 0.0 109.818 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.443 ' O ' ' O ' ' A' ' 75' ' ' ASP . 99.4 mm-40 57.5 148.86 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.842 0.829 . . . . 0.0 110.774 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 139.56 -77.53 0.32 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.649 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 25.1 mt -108.36 24.85 12.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.466 -1.02 . . . . 0.0 109.476 -179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.86 89.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.189 -0.944 . . . . 0.0 109.534 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -64.58 -35.63 81.62 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.306 -0.871 . . . . 0.0 109.485 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.58 ' O ' ' NH2' ' A' ' 38' ' ' ARG . 85.1 mt -83.27 14.74 3.33 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.217 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -74.32 146.78 42.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.417 -0.802 . . . . 0.0 110.362 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.6 m -75.25 135.76 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.436 -0.79 . . . . 0.0 109.907 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.8 157.35 16.18 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -0.842 . . . . 0.0 109.978 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -111.22 143.43 41.99 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.67 -0.644 . . . . 0.0 109.528 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -155.47 126.3 6.99 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.435 -0.791 . . . . 0.0 109.448 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.427 HH21 HD13 ' A' ' 71' ' ' LEU . 22.1 mmm180 53.22 24.75 3.88 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.705 0.764 . . . . 0.0 109.615 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 33' ' ' VAL . . . 89.63 -16.67 55.89 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -84.9 143.17 29.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -1.102 . . . . 0.0 110.49 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -90.12 143.94 26.32 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.468 -0.77 . . . . 0.0 109.063 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.5 mt -124.3 129.9 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.611 -0.68 . . . . 0.0 109.275 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.497 ' O ' ' HB1' ' A' ' 28' ' ' ALA . 31.7 mt-10 -115.5 126.34 27.85 Favored Pre-proline 0 N--CA 1.492 1.663 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.93 158.45 38.54 Favored 'Trans proline' 0 N--CA 1.495 1.588 0 C-N-CA 122.351 2.034 . . . . 0.0 113.098 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.3 -176.6 45.26 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -147.79 124.53 11.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.347 -1.09 . . . . 0.0 109.015 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -146.12 157.46 43.84 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.924 . . . . 0.0 109.06 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -106.5 145.9 31.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.624 -0.672 . . . . 0.0 110.175 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.422 HH21 ' CD1' ' A' ' 21' ' ' ILE . 88.9 mtm180 -92.87 140.03 29.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.459 -0.776 . . . . 0.0 110.117 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -67.44 -28.46 67.91 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.396 -0.815 . . . . 0.0 109.534 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -60.26 -49.02 79.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.238 -0.914 . . . . 0.0 110.463 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.422 ' CD1' HH21 ' A' ' 18' ' ' ARG . 18.7 pt -106.29 0.03 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.493 -0.755 . . . . 0.0 109.502 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 43.19 44.71 4.55 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.413 -0.805 . . . . 0.0 109.833 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -137.92 161.41 36.72 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.397 -0.814 . . . . 0.0 110.081 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -84.32 133.41 34.54 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.572 0.701 . . . . 0.0 110.171 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.6 155.25 41.77 Favored Pre-proline 0 N--CA 1.487 1.395 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -42.42 120.47 1.68 Allowed 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 122.167 1.911 . . . . 0.0 111.9 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -126.18 127.98 46.55 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.704 -0.623 . . . . 0.0 109.747 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -150.99 157.69 43.19 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.307 -0.871 . . . . 0.0 109.2 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 86.0 mt -106.63 135.34 48.32 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -117.35 132.03 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.82 -0.55 . . . . 0.0 109.809 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -131.84 138.6 48.55 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.5 0.667 . . . . 0.0 109.403 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -83.48 135.97 34.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.513 -0.742 . . . . 0.0 110.058 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 8' ' ' GLY . 91.3 t -81.57 131.91 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.421 -0.8 . . . . 0.0 110.045 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 132.93 -66.65 0.57 Allowed Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.46 ' O ' ' O ' ' A' ' 36' ' ' PRO . 19.2 m -98.45 151.68 37.58 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.41 -1.053 . . . . 0.0 110.391 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' VAL . 89.0 Cg_exo -47.42 -166.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 122.805 2.337 . . . . 0.0 113.577 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -81.78 106.63 13.87 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.46 -0.775 . . . . 0.0 109.881 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.462 ' O ' ' O ' ' A' ' 39' ' ' THR . 25.2 mmt85 -107.23 83.05 1.76 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 121.621 0.724 . . . . 0.0 109.157 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 38' ' ' ARG . 9.8 m 47.3 102.2 0.03 OUTLIER Pre-proline 0 N--CA 1.488 1.434 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.108 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.05 146.05 28.63 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 121.957 1.771 . . . . 0.0 112.52 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.413 HD11 ' OD2' ' A' ' 80' ' ' ASP . 31.7 mm -115.07 93.74 36.11 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.25 140.64 51.54 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.13 1.887 . . . . 0.0 112.068 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 t -99.03 136.14 39.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.422 -0.799 . . . . 0.0 109.631 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 65.7 p -132.47 161.06 34.69 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.541 ' O ' ' O ' ' A' ' 46' ' ' PRO . 4.4 t80 -142.03 140.62 19.87 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 45' ' ' TYR . 76.7 Cg_exo -46.24 -131.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.974 2.449 . . . . 0.0 113.39 178.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' PRO . 58.8 mp0 44.29 -170.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.097 -1.002 . . . . 0.0 110.468 179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 49' ' ' TYR . 71.2 m-85 -145.7 149.3 34.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.145 -0.972 . . . . 0.0 109.8 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.413 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 64.1 m-85 -146.9 105.94 3.87 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.475 -0.766 . . . . 0.0 109.133 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -72.65 -17.59 61.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.4 mt -96.53 126.73 41.92 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.81 0.814 . . . . 0.0 109.92 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -69.37 -38.06 77.87 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.457 0.646 . . . . 0.0 109.811 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.01 -46.63 87.7 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.369 -0.832 . . . . 0.0 109.745 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -65.2 -36.03 82.9 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.486 -0.759 . . . . 0.0 109.475 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.33 -38.74 92.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.315 -0.866 . . . . 0.0 109.433 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.77 -48.07 78.41 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.883 . . . . 0.0 109.594 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.93 -46.1 89.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.3 -0.875 . . . . 0.0 109.289 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.8 t -64.0 -42.69 96.5 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.729 -0.607 . . . . 0.0 109.524 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.477 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 45.6 m -55.25 -39.94 70.36 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.079 -1.013 . . . . 0.0 109.566 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.499 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.2 mt -64.03 -44.99 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 120.96 -1.088 . . . . 0.0 109.098 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.92 79.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.9 . . . . 0.0 109.737 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 86.5 m -66.75 -38.29 86.32 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.286 -0.884 . . . . 0.0 109.172 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.8 -43.57 77.0 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.405 -0.809 . . . . 0.0 109.212 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.499 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 33.5 mtmm -62.84 -42.17 99.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.105 -0.997 . . . . 0.0 109.532 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.07 -43.44 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.43 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.63 -43.57 98.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.297 -0.877 . . . . 0.0 109.591 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.23 -45.15 99.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.035 -1.04 . . . . 0.0 109.557 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.83 -41.69 97.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.472 ' O ' ' N ' ' A' ' 73' ' ' ARG . 5.5 t -65.95 -37.91 87.24 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.289 -0.882 . . . . 0.0 109.425 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.65 ' CE1' ' H ' ' A' ' 78' ' ' LEU . 81.7 t60 -56.39 -45.12 80.72 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.217 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.427 HD13 HH21 ' A' ' 7' ' ' ARG . 64.9 mt -65.13 -38.48 90.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.363 -0.836 . . . . 0.0 109.543 179.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -85.89 -73.28 0.46 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.884 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.499 ' O ' ' CB ' ' A' ' 74' ' ' HIS . 33.0 ptt180 -126.59 -140.08 0.27 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.623 -0.673 . . . . 0.0 109.688 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.499 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 13.6 t60 84.78 139.63 0.06 Allowed 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.64 0.733 . . . . 0.0 110.126 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.412 ' O ' ' C ' ' A' ' 76' ' ' GLN . 99.4 m-20 -83.94 111.5 19.31 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.401 -0.812 . . . . 0.0 109.968 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 75' ' ' ASP . 57.8 tt0 36.97 85.21 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.556 0.693 . . . . 0.0 110.933 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.29 -85.5 1.64 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.016 -1.233 . . . . 0.0 110.016 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.65 ' H ' ' CE1' ' A' ' 70' ' ' HIS . 42.8 mt -111.01 31.77 5.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.48 -1.011 . . . . 0.0 109.462 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.44 -36.67 84.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.902 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.42 ' OD2' ' O ' ' A' ' 39' ' ' THR . 21.3 p-10 -59.6 -45.84 90.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 109.893 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.52 -41.45 96.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.252 -0.905 . . . . 0.0 110.197 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 CA-C-O 117.87 -1.517 . . . . 0.0 109.574 -179.642 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.8 ttm . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -82.16 142.23 32.39 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.757 0.789 . . . . 0.0 109.991 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.2 m -82.33 134.27 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.849 0.833 . . . . 0.0 109.967 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.43 160.33 14.85 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.67 0.747 . . . . 0.0 110.094 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -108.0 147.17 31.47 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-O 121.778 0.799 . . . . 0.0 109.812 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -151.71 119.11 5.99 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.864 0.84 . . . . 0.0 110.051 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.434 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 84.7 mtp180 45.85 32.09 1.21 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.441 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 95.22 -23.03 35.33 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -84.03 141.47 31.15 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.516 -0.99 . . . . 0.0 110.317 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -94.3 140.08 30.25 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.742 0.782 . . . . 0.0 109.697 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.8 mt -116.75 128.89 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 CA-C-O 121.678 0.752 . . . . 0.0 109.719 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -123.97 96.49 42.46 Favored Pre-proline 0 N--CA 1.492 1.645 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.13 154.7 37.47 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 122.874 2.383 . . . . 0.0 112.689 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.8 95.75 0.11 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -47.43 146.74 1.93 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.791 -0.829 . . . . 0.0 109.919 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -146.98 157.99 43.79 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.872 0.844 . . . . 0.0 109.799 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -101.34 119.94 39.52 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.733 0.777 . . . . 0.0 109.615 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -95.78 137.86 34.25 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.828 0.823 . . . . 0.0 110.001 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.94 -24.3 41.12 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -62.6 -44.81 95.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.59 -0.693 . . . . 0.0 109.626 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.3 pt -106.98 1.27 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.46 -0.775 . . . . 0.0 109.279 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm-85 42.95 39.59 1.83 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.594 0.711 . . . . 0.0 109.689 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HG3' ' H ' ' A' ' 24' ' ' TYR . 29.4 tptt -145.88 161.46 39.96 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.774 0.797 . . . . 0.0 110.21 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.402 ' H ' ' HG3' ' A' ' 23' ' ' LYS . 95.7 m-85 -85.96 132.7 34.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.916 0.865 . . . . 0.0 109.449 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.6 m -148.1 148.44 29.55 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.796 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.47 110.42 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.745 2.296 . . . . 0.0 111.868 178.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.8 121.44 40.8 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.812 0.815 . . . . 0.0 109.837 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.53 ' O ' HG22 ' A' ' 43' ' ' THR . . . -143.03 154.11 43.65 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.692 0.758 . . . . 0.0 109.995 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.4 mt -111.4 129.43 56.02 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 121.695 0.759 . . . . 0.0 109.321 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -108.81 130.22 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.712 0.768 . . . . 0.0 109.813 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -130.57 130.83 44.56 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.847 0.832 . . . . 0.0 109.704 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -84.76 135.87 33.94 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.841 0.829 . . . . 0.0 109.837 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 73.1 t -66.89 133.54 31.28 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.754 0.788 . . . . 0.0 110.124 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.422 ' O ' HG13 ' A' ' 35' ' ' VAL . . . 105.34 -17.63 43.32 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.422 HG13 ' O ' ' A' ' 34' ' ' GLY . 16.9 m -154.86 56.74 1.51 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.721 -0.87 . . . . 0.0 109.199 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.51 -12.39 31.38 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 122.598 2.199 . . . . 0.0 111.033 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.497 ' CG ' ' H ' ' A' ' 38' ' ' ARG . 65.1 t0 -71.83 -124.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.752 -0.592 . . . . 0.0 109.897 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.497 ' H ' ' CG ' ' A' ' 37' ' ' ASP . 18.6 mmm180 44.28 -171.06 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.661 0.743 . . . . 0.0 110.576 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.9 m -92.03 129.89 40.16 Favored Pre-proline 0 N--CA 1.484 1.255 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.91 147.32 34.2 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 122.367 2.045 . . . . 0.0 112.531 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.8 mm -114.23 126.49 27.93 Favored Pre-proline 0 N--CA 1.487 1.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -74.99 145.54 31.62 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 C-N-CA 122.427 2.085 . . . . 0.0 112.333 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER -122.87 130.73 53.23 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.866 0.841 . . . . 0.0 109.575 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.9 p -141.07 167.42 22.24 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 121.713 0.768 . . . . 0.0 109.568 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.504 ' O ' ' N ' ' A' ' 47' ' ' GLU . 55.3 t80 -123.88 126.84 25.59 Favored Pre-proline 0 N--CA 1.488 1.448 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -46.28 83.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.293 0 C-N-CA 122.446 2.097 . . . . 0.0 112.251 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 45' ' ' TYR . 45.2 tp10 -170.79 147.6 2.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 109.374 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -109.88 127.52 54.77 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.607 0.718 . . . . 0.0 109.686 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -123.05 133.5 54.32 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-O 121.979 0.895 . . . . 0.0 109.778 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -87.09 -24.31 24.61 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -103.72 132.53 49.89 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-O 121.974 0.892 . . . . 0.0 109.732 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.654 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 1.1 pm0 -68.83 -34.86 76.19 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.39 -47.68 72.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.667 -0.646 . . . . 0.0 109.323 -179.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.412 ' O ' HG23 ' A' ' 58' ' ' VAL . 54.4 m-20 -65.21 -37.58 87.73 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.575 -0.703 . . . . 0.0 109.371 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -36.45 82.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.735 -0.603 . . . . 0.0 109.566 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.61 -51.42 67.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.708 -0.62 . . . . 0.0 109.616 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -63.66 -43.47 96.63 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.393 0.616 . . . . 0.0 109.53 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 54' ' ' ASP . 72.5 t -64.96 -39.61 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.3 m -55.89 -43.14 76.96 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.578 -0.701 . . . . 0.0 109.519 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.18 -45.88 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.602 -0.686 . . . . 0.0 109.593 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.87 -36.82 80.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.545 -0.722 . . . . 0.0 109.293 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -65.8 -49.44 68.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.647 -0.658 . . . . 0.0 109.732 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.44 -39.77 64.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.736 -0.602 . . . . 0.0 109.661 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -39.82 94.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.71 -0.619 . . . . 0.0 109.688 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.9 mt -64.68 -43.97 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.67 -0.644 . . . . 0.0 109.855 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -64.36 -43.54 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.528 -0.732 . . . . 0.0 109.462 -179.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 89.2 mt -63.7 -44.71 98.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.434 ' OD1' ' NH1' ' A' ' 7' ' ' ARG . 97.2 m-20 -69.99 -44.77 68.72 Favored 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.429 0.633 . . . . 0.0 109.77 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' ARG . 15.1 t -65.7 -42.02 91.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.666 -0.646 . . . . 0.0 109.781 -179.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -59.24 -44.75 92.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.641 -0.662 . . . . 0.0 109.468 -179.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.2 -43.08 96.15 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.645 -0.66 . . . . 0.0 110.025 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -87.3 -71.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.497 -0.752 . . . . 0.0 109.062 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 69' ' ' SER . 89.0 mtm180 -78.59 147.21 33.79 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.71 0.767 . . . . 0.0 110.043 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -55.49 -87.72 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.477 ' O ' ' N ' ' A' ' 77' ' ' GLY . 58.9 t0 44.02 70.52 0.31 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.442 0.639 . . . . 0.0 109.514 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -43.66 95.27 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.72 0.771 . . . . 0.0 109.817 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 75' ' ' ASP . . . -118.75 -60.75 0.28 Allowed Glycine 0 N--CA 1.494 2.521 0 N-CA-C 108.934 -1.667 . . . . 0.0 108.934 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.5 mt -100.35 21.34 13.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.581 -0.952 . . . . 0.0 108.456 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.34 98.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.931 -0.48 . . . . 0.0 109.944 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.86 -35.83 81.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.682 -0.636 . . . . 0.0 109.547 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.2 mt -85.1 -6.26 59.31 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.641 -0.662 . . . . 0.0 109.5 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.675 0 CA-C-O 117.952 -1.471 . . . . 0.0 109.729 -179.774 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.4 ttp . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -73.96 140.33 45.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.51 -0.743 . . . . 0.0 109.777 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.4 m -87.8 155.18 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.447 -0.783 . . . . 0.0 109.754 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.86 133.28 53.49 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.563 -0.711 . . . . 0.0 109.525 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -83.34 135.17 34.82 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.413 -0.804 . . . . 0.0 109.971 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -144.0 117.86 9.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.347 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.449 ' HE ' ' CD1' ' A' ' 71' ' ' LEU . 78.5 mtp85 53.85 29.15 9.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.551 -0.718 . . . . 0.0 109.758 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.09 -4.56 83.04 Favored Glycine 0 N--CA 1.494 2.531 0 N-CA-C 110.199 -1.161 . . . . 0.0 110.199 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -105.89 134.44 49.02 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.456 -1.026 . . . . 0.0 109.935 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.89 144.6 25.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 109.091 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 78.8 mt -120.19 136.45 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.249 0.547 . . . . 0.0 109.628 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -121.56 85.61 43.71 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -61.48 150.22 86.17 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.858 2.372 . . . . 0.0 112.536 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.566 ' O ' ' CG ' ' A' ' 15' ' ' HIS . . . -174.01 -9.1 0.02 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.566 ' CG ' ' O ' ' A' ' 14' ' ' GLY . 3.9 p-80 56.57 153.34 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.785 -0.832 . . . . 0.0 110.571 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.0 tp60 -169.24 153.11 5.23 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.494 -0.754 . . . . 0.0 109.059 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -98.99 137.49 37.45 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.537 -0.727 . . . . 0.0 109.649 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -92.19 135.95 33.58 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.582 -0.699 . . . . 0.0 109.593 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.47 -19.95 63.75 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.51 -0.744 . . . . 0.0 109.504 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 92.1 m-20 -62.95 -44.65 95.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.477 -0.765 . . . . 0.0 109.88 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 13.2 pt -109.71 2.76 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.666 -0.646 . . . . 0.0 109.289 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 43.44 43.05 4.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.626 -0.672 . . . . 0.0 109.438 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.8 tptm -139.39 164.46 29.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.409 -0.807 . . . . 0.0 109.732 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -85.1 129.97 34.7 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.734 -0.604 . . . . 0.0 109.765 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' H ' ' A' ' 48' ' ' PHE . 0.5 OUTLIER -150.17 155.17 37.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.378 -0.826 . . . . 0.0 108.998 179.512 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -43.47 135.83 6.41 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.198 1.932 . . . . 0.0 112.693 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE2' ' CB ' ' A' ' 42' ' ' PRO . 48.7 t80 -153.5 114.47 4.1 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.39 152.35 49.55 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.388 -0.82 . . . . 0.0 109.706 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.05 129.62 44.89 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 97.4 mt -115.83 131.41 68.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.627 -0.671 . . . . 0.0 110.035 -179.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -132.9 145.74 51.19 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.586 -0.696 . . . . 0.0 109.21 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -82.62 128.23 34.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.211 -0.93 . . . . 0.0 109.797 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 71.4 t -74.54 133.8 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.566 -0.709 . . . . 0.0 110.165 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 115.42 -51.42 0.72 Allowed Glycine 0 N--CA 1.494 2.548 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 36' ' ' PRO . 9.1 m -99.83 151.79 37.6 Favored Pre-proline 0 N--CA 1.497 1.904 0 O-C-N 121.311 -1.111 . . . . 0.0 110.138 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.448 ' O ' ' O ' ' A' ' 35' ' ' VAL . 74.9 Cg_exo -47.36 -170.99 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.715 2.277 . . . . 0.0 113.031 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 37' ' ' ASP . 45.1 p-10 -98.25 108.13 20.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.579 -0.701 . . . . 0.0 109.649 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.567 HH21 ' C ' ' A' ' 81' ' ' LEU . 96.4 mtm-85 -98.44 -173.5 2.57 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.248 -0.908 . . . . 0.0 110.25 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.541 ' O ' HD21 ' A' ' 81' ' ' LEU . 45.9 m -40.15 105.77 0.38 Allowed Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.918 -0.489 . . . . 0.0 109.825 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -75.45 146.86 31.58 Favored 'Trans proline' 0 N--CA 1.493 1.499 0 C-N-CA 122.197 1.932 . . . . 0.0 113.024 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.407 HD12 ' O ' ' A' ' 39' ' ' THR . 4.5 mp -134.35 90.69 24.21 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.479 ' CB ' ' CE2' ' A' ' 27' ' ' TYR . 48.3 Cg_exo -54.72 144.75 63.7 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.319 2.013 . . . . 0.0 111.87 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 t -99.67 136.14 40.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.581 -0.699 . . . . 0.0 109.227 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -136.56 157.52 46.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -139.31 101.35 7.54 Favored Pre-proline 0 N--CA 1.492 1.64 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -50.2 107.14 0.15 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 121.825 1.683 . . . . 0.0 112.475 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 48' ' ' PHE . 54.6 mt-10 -150.66 -13.13 0.24 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.482 ' H ' HG12 ' A' ' 25' ' ' VAL . 1.6 m-85 54.24 108.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.238 0.542 . . . . 0.0 110.1 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -131.54 132.86 44.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.582 -0.699 . . . . 0.0 109.417 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -87.24 -22.11 25.41 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.736 . . . . 0.0 109.316 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -91.12 133.08 35.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.466 -0.771 . . . . 0.0 110.659 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -67.62 -38.02 83.33 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.55 -40.45 91.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 109.759 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 58' ' ' VAL . 99.5 m-20 -62.75 -43.3 99.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.433 -0.792 . . . . 0.0 109.817 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.48 96.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.453 -0.78 . . . . 0.0 110.034 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -66.91 -49.44 65.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.401 -0.812 . . . . 0.0 109.911 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -65.99 -43.65 87.18 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.514 -0.741 . . . . 0.0 109.653 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 54' ' ' ASP . 67.6 t -65.11 -42.65 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.603 -0.686 . . . . 0.0 109.532 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 78.1 p -58.09 -42.23 85.18 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.458 -0.777 . . . . 0.0 109.87 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.421 HG22 ' NZ ' ' A' ' 64' ' ' LYS . 97.4 mt -64.81 -44.85 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.139 -0.975 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.06 -44.36 80.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.502 -0.749 . . . . 0.0 109.485 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 94.1 m -65.86 -43.62 87.83 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.583 -0.698 . . . . 0.0 109.265 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -50.17 -42.91 51.96 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.421 ' NZ ' HG22 ' A' ' 60' ' ' ILE . 64.2 mttp -63.31 -43.01 99.03 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.489 -0.757 . . . . 0.0 109.302 179.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.12 -44.75 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.375 -0.828 . . . . 0.0 109.774 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.0 mp -66.04 -45.93 89.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.376 -0.828 . . . . 0.0 109.138 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.8 mt -64.75 -44.65 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.485 -0.759 . . . . 0.0 109.629 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -68.52 -46.35 69.8 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.538 -0.727 . . . . 0.0 109.87 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.6 m -62.63 -42.15 99.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.568 -0.708 . . . . 0.0 110.094 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.402 ' O ' ' O ' ' A' ' 73' ' ' ARG . 76.3 t60 -59.16 -42.34 90.51 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.754 . . . . 0.0 109.674 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.449 ' CD1' ' HE ' ' A' ' 7' ' ' ARG . 81.9 mt -64.88 -36.0 82.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.588 -0.695 . . . . 0.0 109.719 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -64.93 -16.59 63.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.854 . . . . 0.0 109.626 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.402 ' O ' ' O ' ' A' ' 70' ' ' HIS . 17.3 ptm180 -151.44 -145.21 0.17 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.275 -0.891 . . . . 0.0 109.223 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.468 ' O ' ' CD2' ' A' ' 74' ' ' HIS . 53.2 p-80 -141.07 43.77 1.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.304 -0.873 . . . . 0.0 108.908 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.527 ' O ' ' N ' ' A' ' 77' ' ' GLY . 53.5 t0 -63.3 123.52 18.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.414 -0.804 . . . . 0.0 109.157 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -42.68 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.62 -0.675 . . . . 0.0 109.841 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.527 ' N ' ' O ' ' A' ' 75' ' ' ASP . . . -152.96 -83.01 0.04 OUTLIER Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.6 mt -101.91 17.87 22.03 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.536 -0.979 . . . . 0.0 109.521 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.93 -38.68 89.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.393 -0.817 . . . . 0.0 109.48 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.85 -37.28 86.79 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.524 -0.735 . . . . 0.0 109.835 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.567 ' C ' HH21 ' A' ' 38' ' ' ARG . 54.2 mt -83.38 -3.14 57.24 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.354 -0.841 . . . . 0.0 109.121 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.82 . . . . . . . . 0 0 . 1 stop_ save_