data_6i9h_residue ############################ # Computer software used # ############################ 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 6i9h _Structure_validation_residue.Date_analyzed 2019-04-26 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 ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -89.39 37.42 0.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 110.504 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.44 -12.32 30.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.773 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.5 mt -49.66 -23.11 1.56 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.125 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -59.46 -44.26 93.03 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.872 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 71.5 mt -104.74 -41.28 5.7 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.621 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.56 -88.04 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 167.33 -78.92 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.081 0 O-C-N 123.706 0.629 . . . . 0.0 110.92 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -114.12 167.02 11.04 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.243 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 3.5 t -78.24 135.29 37.55 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.49 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.06 -38.71 94.29 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 121.564 -0.35 . . . . 0.0 113.068 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.08 -43.35 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.2 p -107.11 -18.74 13.81 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.865 0.364 . . . . 0.0 111.605 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.47 40.28 8.42 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.294 0.568 . . . . 0.0 110.491 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -130.84 146.77 52.37 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.175 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -52.17 149.23 5.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.601 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.6 mt -79.57 105.83 11.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.714 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -85.39 167.25 26.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.94 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.69 -51.57 10.82 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.476 1.451 . . . . 0.0 112.625 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.25 -5.03 33.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.522 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -66.67 -26.12 66.89 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.838 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 46.71 70.06 2.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 O-C-N 123.584 0.553 . . . . 0.0 109.614 -178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.18 145.06 77.47 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.923 2.415 . . . . 0.0 111.697 -178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -141.93 143.72 33.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.37 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.94 123.51 45.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.839 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.5 mp -83.55 168.19 23.81 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.605 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -68.17 -14.57 40.96 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 123.154 2.569 . . . . 0.0 112.28 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.2 p -88.48 -0.77 57.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.237 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 75.52 46.37 0.11 Allowed 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 123.832 0.708 . . . . 0.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -134.12 117.53 16.68 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.881 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.0 m -87.59 141.45 28.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.096 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -156.88 164.59 37.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.805 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.431 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -62.95 137.22 58.21 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.556 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -56.38 -43.18 79.0 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.042 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.1 92.51 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.471 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.2 m -67.26 -33.56 75.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.29 0.567 . . . . 0.0 110.308 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 90.4 mt -68.81 -28.64 66.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.64 -62.3 6.36 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.562 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.27 -19.35 42.06 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 123.071 2.514 . . . . 0.0 111.758 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.63 77.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.577 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.455 -179.94 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.364 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.8 t0 68.68 82.93 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.788 0.328 . . . . 0.0 110.721 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.39 -17.1 37.4 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -116.16 -119.33 0.31 Allowed 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.4 m -63.17 152.72 7.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.962 0.41 . . . . 0.0 110.096 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 82.8 t -127.98 142.06 44.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.745 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -80.52 125.41 29.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.636 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.7 135.47 19.77 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.331 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.68 -11.14 10.84 Favored 'Trans proline' 0 C--N 1.303 -1.868 0 CA-C-N 120.613 1.255 . . . . 0.0 112.939 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 22.3 t -94.35 -60.86 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.574 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.8 p -98.42 -26.37 14.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.975 0.416 . . . . 0.0 110.543 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mptt 57.64 35.24 25.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.978 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.66 144.81 4.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.918 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.04 153.68 40.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.659 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 92.7 m -95.69 -44.55 7.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.181 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -142.47 160.12 40.9 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.31 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.88 27.02 7.42 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.577 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -61.55 -41.46 97.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.452 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -105.32 16.37 25.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.327 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.57 -176.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.133 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.6 m -38.76 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.956 0.785 . . . . 0.0 109.762 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 161.97 -21.31 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.894 1.371 . . . . 0.0 111.244 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -106.89 30.46 6.11 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.978 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -42.43 118.42 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.321 0.581 . . . . 0.0 111.314 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -63.45 -51.92 63.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 171.03 -168.53 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.395 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -115.82 92.46 3.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.878 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.34 -10.01 55.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.007 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.9 p . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 120.782 0.325 . . . . 0.0 110.4 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 120.751 0.31 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -90.23 20.3 4.48 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.403 0.62 . . . . 0.0 111.172 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.52 -12.2 14.21 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.672 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.5 mt -49.61 -23.4 1.67 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.281 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -59.66 -42.28 92.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.014 0.435 . . . . 0.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.96 -40.14 6.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.718 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -85.53 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 167.1 -80.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 O-C-N 123.98 0.8 . . . . 0.0 110.649 179.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -109.24 164.67 12.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.55 0.69 . . . . 0.0 110.714 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 24.1 t -80.22 136.27 36.43 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.092 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.06 -35.6 89.34 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.399 -0.364 . . . . 0.0 112.727 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.75 -39.35 79.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -177.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.4 p -116.59 -17.43 10.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.487 . . . . 0.0 111.409 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.98 40.23 7.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.586 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.99 147.21 50.49 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.161 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -54.26 149.36 9.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.64 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.2 mt -79.73 109.46 14.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.92 -178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -73.51 161.41 79.09 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.451 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -57.79 -40.25 80.52 Favored 'Trans proline' 0 N--CA 1.495 1.571 0 C-N-CA 122.261 1.974 . . . . 0.0 111.742 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -89.68 1.25 56.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.223 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.16 -24.8 65.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.943 0.401 . . . . 0.0 111.681 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 54.3 71.76 1.27 Allowed Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.137 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.0 152.26 57.03 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 C-N-CA 122.752 2.302 . . . . 0.0 111.085 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.75 166.95 23.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.307 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 tp -118.43 126.78 52.79 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 mp -85.67 168.53 19.35 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -67.08 -15.71 47.31 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 123.332 2.688 . . . . 0.0 112.538 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 11.2 p -93.44 1.12 56.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.4 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.02 51.51 0.11 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.38 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 56.2 m170 -128.07 121.46 29.73 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.51 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -87.6 132.37 34.09 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.235 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -150.22 162.04 41.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.803 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 4.0 m -66.51 136.55 55.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -56.57 -42.06 77.96 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.573 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.96 91.59 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.1 m -68.19 -32.99 73.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.239 0.542 . . . . 0.0 110.009 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 93.7 mt -70.78 -26.67 63.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.849 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.66 -60.0 9.78 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.8 -0.715 . . . . 0.0 111.751 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.31 -16.36 34.15 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.95 2.434 . . . . 0.0 111.993 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.3 -38.47 80.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.679 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.385 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.216 179.929 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.349 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.5 t0 77.38 87.23 0.08 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.018 0.437 . . . . 0.0 111.37 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.36 -18.09 39.24 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.6 t -116.81 -122.84 0.29 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.45 149.38 9.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.113 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.4 t -123.49 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.729 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -67.37 92.01 0.28 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.661 0.743 . . . . 0.0 109.688 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 9.1 t -75.33 132.79 75.48 Favored Pre-proline 0 C--O 1.212 -0.89 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.845 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.98 -14.13 35.4 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 120.803 1.322 . . . . 0.0 112.531 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 6.6 t -94.75 -50.37 11.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.296 -0.562 . . . . 0.0 112.414 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.57 -29.27 10.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.377 0.608 . . . . 0.0 110.095 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 57.48 29.51 17.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.828 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -170.31 100.76 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.523 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -100.47 143.48 30.61 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.175 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.43 -54.29 25.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.564 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -145.18 171.69 14.17 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.121 0.486 . . . . 0.0 110.798 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 13.7 p -93.57 8.78 39.44 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.552 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.87 -40.95 97.74 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.474 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -101.17 9.86 41.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.627 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -86.15 -172.1 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.655 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.6 m -39.32 104.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 O-C-N 123.504 0.503 . . . . 0.0 110.983 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 162.86 -25.02 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 125.022 1.451 . . . . 0.0 110.56 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -104.6 57.55 0.7 Allowed 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.43 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 6.4 p90 -52.38 141.37 19.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.302 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -102.18 -74.97 0.61 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.368 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.1 ttt -151.26 144.43 24.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.726 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -83.92 62.63 7.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.837 0.351 . . . . 0.0 110.182 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -61.5 139.8 58.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.157 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 -179.42 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -89.33 21.34 3.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.253 0.549 . . . . 0.0 110.947 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.12 -12.23 18.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.674 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.5 mt -49.73 -22.31 1.35 Allowed 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.222 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.02 -44.45 91.73 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.822 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 mt -104.81 -41.47 5.63 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.513 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.34 -89.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 165.41 -79.99 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.107 0 O-C-N 123.879 0.737 . . . . 0.0 110.799 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -106.42 165.74 11.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.181 0.515 . . . . 0.0 110.319 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 18.9 t -80.02 137.03 36.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.764 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.08 -34.99 82.8 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 121.658 -0.306 . . . . 0.0 112.796 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.99 -42.32 89.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.1 p -111.25 -18.6 12.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.975 0.417 . . . . 0.0 111.234 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 64.17 38.56 8.16 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -128.03 144.32 51.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.207 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 149.37 2.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.395 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.0 mt -78.97 106.9 11.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.641 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.05 157.98 86.28 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.52 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.82 -38.45 95.8 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 121.985 1.79 . . . . 0.0 111.369 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -87.92 -0.59 57.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.308 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.55 -24.67 65.55 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 120.742 0.306 . . . . 0.0 111.703 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 56.56 70.02 1.58 Allowed Pre-proline 0 N--CA 1.442 -0.842 0 CA-C-O 121.405 0.621 . . . . 0.0 109.943 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.91 147.6 74.8 Favored 'Trans proline' 0 C--N 1.301 -1.948 0 C-N-CA 123.052 2.501 . . . . 0.0 111.485 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 mtm-85 -138.02 161.24 37.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.587 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.5 tp -116.97 124.77 50.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.037 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.2 mp -87.99 162.8 39.89 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.414 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.74 -8.9 24.79 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 123.066 2.511 . . . . 0.0 112.419 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 22.1 p -92.44 2.42 56.68 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.067 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 73.9 41.68 0.4 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.488 0.661 . . . . 0.0 110.989 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -133.32 118.79 18.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.4 m -86.89 139.06 31.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.09 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -151.66 165.19 35.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.848 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.415 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -70.88 139.35 50.77 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -54.65 -43.41 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.237 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -40.08 92.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.6 m -67.78 -34.73 77.36 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.49 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 82.1 mt -64.93 -31.46 72.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.974 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.7 -63.07 4.4 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.469 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.25 -15.2 46.72 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 122.484 2.122 . . . . 0.0 112.321 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.51 -36.3 75.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.519 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.535 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.323 -179.678 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.242 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 t0 70.87 74.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.848 0.356 . . . . 0.0 110.937 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.17 -17.43 37.61 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -178.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 66.7 p -115.44 -119.31 0.31 Allowed 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.484 0.183 . . . . 0.0 110.513 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.3 m -59.13 141.97 15.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.214 0.531 . . . . 0.0 110.516 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.9 139.62 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.591 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -84.58 108.18 17.2 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.331 0.586 . . . . 0.0 110.281 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 1.6 t -96.61 135.92 22.05 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.414 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -55.16 -18.05 16.78 Favored 'Trans proline' 0 C--N 1.297 -2.144 0 C-N-CA 121.072 1.181 . . . . 0.0 112.86 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.64 -63.09 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.006 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 22.4 p -87.62 -28.44 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.86 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 50.53 25.0 1.79 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.851 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -166.53 122.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.845 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -123.91 143.09 50.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.732 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 50.8 t -63.47 -51.08 67.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.907 0.384 . . . . 0.0 110.721 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -146.4 176.02 10.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.341 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 59.5 p -108.04 53.56 0.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.775 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -87.42 -40.39 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.742 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.5 22.82 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 111.581 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.7 pt -62.87 -171.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -37.9 109.43 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 O-C-N 123.901 0.751 . . . . 0.0 110.393 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 167.96 -30.78 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 124.793 1.308 . . . . 0.0 111.014 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -84.88 72.65 10.75 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 120.296 -0.561 . . . . 0.0 111.068 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -93.39 26.93 2.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -59.93 -47.78 84.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.942 0.401 . . . . 0.0 110.514 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.4 tpt -73.95 125.96 29.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.812 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -144.62 96.35 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.818 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -124.23 144.44 49.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.605 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 p . . . . . 0 C--N 1.331 -0.207 0 CA-C-O 120.917 0.389 . . . . 0.0 111.007 -179.891 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.912 0.387 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -87.94 22.08 2.48 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.555 0.693 . . . . 0.0 111.051 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.77 -12.22 16.0 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.777 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 44.2 mt -49.46 -22.97 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.181 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.71 -42.9 94.07 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.535 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.92 -40.29 6.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.639 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.28 -86.6 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 166.94 -78.38 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 O-C-N 123.906 0.754 . . . . 0.0 110.904 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -106.71 164.58 11.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.351 0.596 . . . . 0.0 110.438 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.2 t -80.94 137.11 36.12 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.869 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.35 -36.11 88.72 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 121.778 -0.248 . . . . 0.0 112.799 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 61.5 t -59.46 -40.04 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 5.6 p -114.19 -18.3 11.66 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.915 0.388 . . . . 0.0 111.128 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 64.14 38.35 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.347 0.594 . . . . 0.0 110.664 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -127.14 144.4 51.04 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.844 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -51.87 150.87 3.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.715 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.3 mt -78.02 105.11 9.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.298 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -79.24 166.89 38.74 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.94 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.31 -47.82 24.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.046 1.831 . . . . 0.0 112.982 -177.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -82.2 2.8 29.98 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.508 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -63.94 -25.76 68.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.311 -178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.436 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 79.3 tt0 50.73 65.96 6.08 Favored Pre-proline 0 N--CA 1.446 -0.66 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.581 -178.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.436 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 22.6 Cg_exo -62.48 150.19 88.33 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 123.161 2.574 . . . . 0.0 112.279 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mtt85 -149.66 147.24 27.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.155 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.04 114.37 28.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.924 0.392 . . . . 0.0 111.264 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -66.37 165.25 24.58 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 121.066 0.46 . . . . 0.0 110.944 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -63.63 -14.71 44.32 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 C-N-CA 123.091 2.527 . . . . 0.0 112.392 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 18.5 p -90.5 2.87 55.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.352 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 75.41 47.94 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.835 0.71 . . . . 0.0 111.373 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -129.95 121.16 26.03 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.649 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -86.77 133.29 33.67 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.122 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.13 167.15 30.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.646 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -69.11 149.73 48.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.342 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -58.88 -44.43 91.12 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.077 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.45 97.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.881 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.3 m -70.0 -28.05 65.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.658 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.09 -34.31 74.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.375 179.478 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.1 -57.97 10.39 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.97 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.92 -11.87 23.27 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.053 1.836 . . . . 0.0 112.832 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.44 80.15 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.014 0.435 . . . . 0.0 110.395 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.392 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.788 -179.683 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.451 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.3 t0 73.43 82.38 0.12 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.013 0.435 . . . . 0.0 111.774 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.29 -18.65 35.63 Favored Glycine 0 C--N 1.332 0.332 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.2 t -117.67 -119.99 0.31 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.307 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.2 m -61.21 155.32 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.941 0.4 . . . . 0.0 110.893 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 73.8 t -119.78 140.1 44.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -84.97 109.3 18.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.811 0.815 . . . . 0.0 111.165 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.1 t -103.5 130.95 22.57 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 114.385 -1.28 . . . . 0.0 109.552 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -55.15 -15.4 10.58 Favored 'Trans proline' 0 C--N 1.302 -1.878 0 C-N-CA 121.236 1.291 . . . . 0.0 112.956 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.3 t -92.49 -62.54 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.34 -0.544 . . . . 0.0 112.148 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.6 p -95.49 -26.38 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.565 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 mptt 53.93 24.56 4.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.674 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 tm0? -162.82 128.61 3.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.607 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -136.59 139.06 41.86 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 53.0 t -61.44 -49.4 76.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 110.295 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -145.04 177.06 9.04 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.415 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 3.8 p -122.29 48.37 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.278 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -87.15 -22.9 25.04 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.992 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -109.13 18.34 20.67 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.872 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.8 pt -64.06 -169.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.812 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 m -39.05 104.32 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.281 0 O-C-N 123.867 0.729 . . . . 0.0 110.237 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 162.91 -13.24 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 124.735 1.272 . . . . 0.0 111.427 -178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -90.85 20.33 4.87 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 119.752 -0.779 . . . . 0.0 111.116 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -42.09 105.77 0.05 Allowed 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.54 0.525 . . . . 0.0 110.952 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -85.05 -74.4 0.4 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 55.0 ttp -152.83 148.61 27.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 78.3 mtm-85 -86.28 65.6 9.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.141 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -55.41 125.27 20.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.783 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 p . . . . . 0 C--N 1.333 -0.132 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.781 -179.541 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.93 0.395 . . . . 0.0 110.585 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.84 20.23 4.94 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.499 0.666 . . . . 0.0 110.651 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -11.68 14.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.819 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.8 mt -48.27 -23.51 0.91 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.894 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.53 -44.01 93.29 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.713 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 mt -104.44 -41.83 5.63 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.716 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.81 -89.99 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 165.27 -67.72 0.0 OUTLIER 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.93 0.769 . . . . 0.0 111.455 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -118.11 163.85 16.01 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.271 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 5.3 t -81.51 140.04 34.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.993 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.27 -38.65 93.92 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.334 -0.46 . . . . 0.0 113.283 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -59.96 -44.07 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 26.7 p -106.33 -20.38 13.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.931 0.396 . . . . 0.0 111.582 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 65.04 36.03 7.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.503 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.11 146.5 50.68 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.379 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.0 tpp180 -52.02 148.64 5.86 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.466 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.6 mt -73.43 101.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.244 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -71.4 166.94 34.3 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.753 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -55.39 -43.1 61.64 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.267 1.978 . . . . 0.0 113.172 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -87.06 2.7 48.84 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.431 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -64.68 -25.66 68.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.677 0.275 . . . . 0.0 111.333 -178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 47.8 68.92 3.04 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.809 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -66.98 140.77 55.75 Favored 'Trans proline' 0 C--N 1.298 -2.122 0 C-N-CA 122.971 2.447 . . . . 0.0 111.791 -178.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -135.22 145.55 47.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.583 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 tp -100.29 122.18 42.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 mp -81.31 166.31 39.15 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.82 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -61.93 -16.68 51.2 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 123.015 2.476 . . . . 0.0 112.139 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.7 p -88.49 -1.22 57.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.403 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.27 45.66 0.19 Allowed 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 123.758 0.661 . . . . 0.0 110.998 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -129.71 122.23 28.5 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.443 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -86.52 138.06 32.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.217 -179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -153.46 165.64 35.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.731 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -68.73 138.77 55.16 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -56.28 -42.5 77.58 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.025 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.07 92.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 87.1 m -65.81 -36.39 83.36 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.156 0.503 . . . . 0.0 110.349 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 92.0 mt -66.72 -29.66 69.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.173 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.32 -60.67 6.06 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.79 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.57 -16.5 55.02 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.188 1.925 . . . . 0.0 112.452 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.58 -24.59 65.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.655 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.694 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -177.42 58.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.09 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 101.82 -15.96 56.47 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 -179.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 81.3 p -107.07 -121.23 0.24 Allowed 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.289 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 26.5 m -60.5 141.72 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-O 121.137 0.494 . . . . 0.0 109.94 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 50.6 t -107.47 131.12 58.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.581 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 49.4 p-10 -79.29 84.54 5.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.072 0.939 . . . . 0.0 109.901 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.61 137.08 77.37 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.822 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -55.34 -18.69 19.57 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 CA-C-N 120.21 1.111 . . . . 0.0 113.182 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.7 t -95.58 -63.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.479 -0.489 . . . . 0.0 112.202 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 20.7 p -86.6 -28.76 23.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.678 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 49.55 26.14 1.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.975 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -165.31 119.82 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.592 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -123.33 171.19 9.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.621 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 96.1 m -94.78 -51.94 4.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.478 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -145.02 174.98 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.606 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 64.8 p -108.43 50.12 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.054 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.05 -38.75 15.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.567 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.13 19.09 20.88 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.871 0.367 . . . . 0.0 111.774 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 8.6 pt -61.41 -170.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.731 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.3 m -38.89 105.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 O-C-N 123.817 0.698 . . . . 0.0 110.547 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 174.91 -34.21 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.583 0 O-C-N 124.286 0.991 . . . . 0.0 110.812 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -84.51 72.53 10.63 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.815 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -68.76 138.14 54.61 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.936 0.398 . . . . 0.0 111.161 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -107.46 -177.09 3.25 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.39 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 98.2 mtp -62.0 149.53 40.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.233 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -79.37 59.3 2.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.201 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -62.05 117.43 5.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.321 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 85.1 p . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.693 -179.371 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -89.54 24.89 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.566 0.698 . . . . 0.0 111.064 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.69 -12.05 14.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.65 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.6 mt -48.65 -23.3 0.98 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.171 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.55 -43.08 93.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.01 0.433 . . . . 0.0 110.641 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.8 mt -104.39 -40.61 6.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.647 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.36 -86.71 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 166.55 -81.02 0.0 OUTLIER 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.79 0.681 . . . . 0.0 110.96 179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.5 p-80 -113.35 163.21 15.14 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.34 0.591 . . . . 0.0 110.416 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 12.8 t -76.11 134.47 39.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.159 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -36.92 92.88 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 116.407 -0.36 . . . . 0.0 112.9 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.5 t -60.04 -42.59 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 22.2 p -110.83 -18.16 13.17 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 63.72 37.84 9.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.391 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -125.31 145.89 49.81 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.773 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -52.67 147.44 8.63 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.26 109.79 8.03 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.874 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -77.71 157.51 79.46 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.112 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.34 -33.76 94.09 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.603 1.535 . . . . 0.0 111.249 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -90.4 -2.08 57.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.375 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -23.91 65.96 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 111.655 -178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.407 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 85.9 tt0 56.12 66.95 3.12 Favored Pre-proline 0 N--CA 1.446 -0.639 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.857 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.407 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.0 Cg_exo -61.99 146.93 96.06 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.995 2.463 . . . . 0.0 111.995 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -140.44 148.15 40.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.417 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 tp -102.69 130.0 49.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.173 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -89.28 166.58 20.89 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 121.081 0.467 . . . . 0.0 111.21 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.43 -20.72 69.59 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 123.268 2.645 . . . . 0.0 112.691 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.6 p -87.42 0.78 55.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.047 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 74.67 47.48 0.12 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.892 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.6 m170 -129.6 123.98 32.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.151 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -86.64 131.47 34.14 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.257 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -144.11 162.52 36.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.485 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.09 149.12 48.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.344 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 t -60.04 -46.52 89.24 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.396 0.617 . . . . 0.0 110.199 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.99 95.58 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.785 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.6 m -70.08 -25.8 63.69 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.959 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.89 -34.36 73.44 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.542 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -52.99 -58.68 10.94 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.815 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.77 -18.63 21.91 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 123.008 2.472 . . . . 0.0 112.582 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.05 -36.68 75.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.788 0.327 . . . . 0.0 110.344 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.053 179.827 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.293 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.4 t0 74.08 81.37 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.889 0.376 . . . . 0.0 110.572 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.0 -18.13 37.15 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 67.6 p -115.57 -118.85 0.32 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 21.3 m -60.68 132.95 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.164 0.507 . . . . 0.0 110.312 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.53 131.27 56.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.066 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -71.14 135.56 47.69 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.591 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.476 ' O ' ' N ' ' A' ' 121' ' ' LYS . 24.3 t -115.75 132.86 22.95 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.814 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -54.33 -17.83 13.04 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 CA-C-N 120.794 1.319 . . . . 0.0 112.493 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.7 t -94.38 -50.54 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.48 -31.31 11.35 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.452 0.644 . . . . 0.0 110.265 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.3 mptt 57.65 26.98 13.59 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.831 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -169.64 110.44 0.44 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.779 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -103.25 160.51 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.683 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 74.7 m -93.46 -44.42 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -145.3 167.78 22.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.534 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 51.3 p -105.16 44.45 1.03 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -88.42 -36.34 16.57 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -108.29 21.25 17.59 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 13.3 pt -70.33 -170.02 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.424 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -38.73 108.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 O-C-N 123.782 0.676 . . . . 0.0 110.39 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.1 -27.33 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 124.613 1.196 . . . . 0.0 110.772 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -84.41 74.46 10.36 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.753 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -85.67 114.02 22.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.031 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -96.79 -179.68 4.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.307 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 17.0 ptm -49.33 159.9 0.28 Allowed 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -98.36 80.24 2.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.446 -179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -80.7 106.61 12.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.553 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.452 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.42 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.83 0.348 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -92.03 21.87 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.461 0.648 . . . . 0.0 110.847 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.04 -12.42 11.69 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.815 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 35.5 mt -49.58 -23.64 1.76 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.347 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.39 -43.27 92.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 68.5 mt -104.19 -40.62 6.07 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.936 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.8 -87.87 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 165.79 -79.28 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 O-C-N 124.06 0.85 . . . . 0.0 110.969 178.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -108.26 164.43 12.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.166 0.508 . . . . 0.0 110.513 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.17 135.03 39.76 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.931 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.41 -37.8 94.2 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 121.442 -0.409 . . . . 0.0 113.011 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.8 t -62.02 -42.71 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.53 -16.05 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.03 0.443 . . . . 0.0 110.962 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.12 29.22 16.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.415 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -114.89 143.83 44.51 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.496 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.2 ttt180 -54.4 151.35 7.71 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.769 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.54 104.2 8.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.192 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -77.34 157.22 80.82 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.363 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -56.16 -38.65 94.58 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 C-N-CA 121.787 1.658 . . . . 0.0 111.064 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -86.86 -1.88 58.15 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.898 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -67.86 -24.24 65.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.982 0.42 . . . . 0.0 111.134 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.426 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 78.5 tt0 57.65 65.71 3.3 Favored Pre-proline 0 N--CA 1.445 -0.705 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.296 -178.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.5 Cg_exo -63.05 146.45 94.59 Favored 'Trans proline' 0 C--N 1.301 -1.931 0 C-N-CA 122.367 2.044 . . . . 0.0 111.221 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -140.15 148.79 42.15 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.294 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.6 tp -103.38 127.53 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.142 0.496 . . . . 0.0 111.445 -178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.4 mp -89.77 164.62 28.2 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.234 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.41 -6.73 19.8 Favored 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 123.037 2.491 . . . . 0.0 112.532 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 20.0 p -94.11 -0.87 55.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.404 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 77.46 41.52 0.14 Allowed 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 123.926 0.766 . . . . 0.0 110.969 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -134.58 119.2 18.11 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.679 178.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.5 m -87.02 140.26 29.74 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -152.41 164.1 38.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.578 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.422 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -65.34 137.59 57.62 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -56.32 -43.43 78.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.516 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.74 91.12 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 84.2 m -67.48 -33.55 75.34 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.53 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 74.7 mt -65.53 -37.33 86.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.04 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -47.57 -63.71 3.28 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.78 -27.03 69.47 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.882 2.388 . . . . 0.0 111.787 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.02 -39.67 86.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.559 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.531 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.054 179.447 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.9 t0 70.23 76.2 0.2 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.924 0.392 . . . . 0.0 110.972 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.64 -13.16 46.77 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.4 p -115.99 -120.64 0.3 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.549 -0.325 . . . . 0.0 110.451 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.0 m -64.24 151.66 9.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.058 0.456 . . . . 0.0 110.673 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.89 133.89 65.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.819 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.23 113.71 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.151 0.501 . . . . 0.0 110.025 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.96 138.31 19.77 Favored Pre-proline 0 C--O 1.213 -0.828 0 CA-C-N 115.228 -0.897 . . . . 0.0 108.832 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.66 -15.41 48.58 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 121.165 1.243 . . . . 0.0 112.58 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 52.1 t -94.46 -61.99 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.576 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -90.45 -24.85 20.6 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.433 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.7 mptt 49.75 24.25 1.2 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.839 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.13 116.37 0.84 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -118.38 156.97 28.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.615 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 6.4 t -83.46 -49.95 8.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.15 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -141.19 176.8 8.55 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.489 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.03 50.79 1.11 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.56 0.695 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -85.03 -26.84 26.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.462 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -113.62 23.72 12.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 111.43 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 15.3 pt -60.16 -172.34 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.784 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 m -41.24 104.58 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 O-C-N 123.758 0.662 . . . . 0.0 110.698 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.38 -33.52 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.405 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -82.96 68.57 9.5 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.573 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -95.67 32.73 1.77 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -61.71 -39.04 90.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.55 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.7 mmt -95.14 127.61 41.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.104 0.478 . . . . 0.0 110.9 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -136.51 45.4 2.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.754 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -62.8 145.2 55.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.636 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.125 0 CA-C-O 120.813 0.339 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -89.27 12.39 16.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.97 -11.29 3.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.11 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.1 mt -47.39 -28.15 1.96 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.515 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -49.26 -45.98 45.61 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.67 -40.84 5.86 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.599 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.1 -83.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 123.432 0.457 . . . . 0.0 109.777 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 164.65 -76.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.091 0.869 . . . . 0.0 111.303 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 -103.06 165.2 11.16 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.386 0.612 . . . . 0.0 110.41 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 20.2 t -81.35 135.94 35.71 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.205 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.09 92.67 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 116.521 -0.308 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.37 -41.16 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 4.4 p -113.56 -16.16 12.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.923 0.392 . . . . 0.0 111.16 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 62.99 38.83 10.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.319 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -128.1 145.28 51.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.098 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -51.69 153.78 2.25 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.336 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.5 mt -82.56 102.42 11.39 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.863 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -66.56 162.17 52.73 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.151 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.31 -39.24 86.06 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 121.924 1.75 . . . . 0.0 111.05 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -90.17 0.81 56.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.512 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -66.88 -23.74 66.04 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.126 0.489 . . . . 0.0 110.784 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 50.61 74.51 0.79 Allowed Pre-proline 0 N--CA 1.45 -0.429 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -70.71 152.81 64.67 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 123.03 2.487 . . . . 0.0 112.283 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -147.14 152.43 38.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.656 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 tp -108.92 128.41 54.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.313 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -83.84 165.58 38.66 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.295 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -62.4 -16.7 53.37 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 123.126 2.551 . . . . 0.0 112.251 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.5 p -88.42 -0.9 57.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.4 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.34 49.17 0.07 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.432 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -133.99 124.02 25.59 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.605 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.4 m -86.52 140.28 30.06 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.307 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -156.08 163.83 39.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.916 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.3 m -65.14 149.87 49.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.211 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.3 t -59.99 -46.35 89.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.645 0.736 . . . . 0.0 109.796 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.23 96.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.271 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 99.4 m -69.88 -26.79 64.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 109.729 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.9 -38.25 85.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.696 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.9 -60.17 7.31 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.81 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.21 -29.29 37.15 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 123.283 2.655 . . . . 0.0 112.372 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.4 81.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.186 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.04 179.628 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.348 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t0 71.95 79.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.892 0.377 . . . . 0.0 111.006 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.58 -16.43 40.77 Favored Glycine 0 N--CA 1.453 -0.213 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.5 p -114.91 -120.55 0.3 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.647 -0.276 . . . . 0.0 110.356 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 2.7 m -66.96 138.33 23.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.415 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.1 t -110.47 132.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.8 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 122.52 25.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.731 0.777 . . . . 0.0 109.944 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 49.7 t -108.94 135.52 20.13 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.655 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.41 -11.19 15.64 Favored 'Trans proline' 0 C--N 1.302 -1.897 0 C-N-CA 121.084 1.19 . . . . 0.0 112.679 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -93.97 -62.41 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.648 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 10.2 p -96.8 -24.73 15.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.936 0.398 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 54.73 29.54 11.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.808 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -156.48 139.03 14.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.118 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -141.64 158.42 43.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.714 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 34.6 t -94.66 -55.04 3.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.169 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -144.0 175.18 10.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.564 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 78.9 p -104.46 54.24 0.73 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.674 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -87.62 -43.03 12.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.528 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -107.8 19.23 20.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.667 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.7 pt -59.02 -172.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.624 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -39.33 112.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 O-C-N 123.827 0.704 . . . . 0.0 110.608 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 165.74 -29.62 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 124.621 1.201 . . . . 0.0 110.713 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -87.64 101.14 13.36 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.742 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 48.2 p90 -108.37 143.63 37.02 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.608 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -108.66 -81.01 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 16.8 tpt -145.09 141.24 28.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -89.27 44.55 1.22 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.742 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -81.82 146.41 29.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.686 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 52.7 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.845 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.12 0.486 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -88.93 30.72 0.91 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.442 0.639 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.92 -12.5 18.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.529 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 38.9 mt -49.23 -23.63 1.43 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.242 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -59.24 -43.21 92.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.989 0.423 . . . . 0.0 110.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.0 mt -104.3 -40.64 6.04 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.94 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.27 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 165.12 -79.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 O-C-N 123.987 0.804 . . . . 0.0 110.978 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -106.2 166.4 10.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.239 0.542 . . . . 0.0 110.688 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.6 t -79.2 135.34 36.77 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.259 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.28 -37.91 93.28 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.615 -0.326 . . . . 0.0 112.851 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.32 -41.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.0 p -110.04 -18.07 13.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.95 0.405 . . . . 0.0 111.204 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.34 39.67 9.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.53 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -128.76 144.1 51.08 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.123 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -50.7 152.6 1.97 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.366 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -81.14 112.47 18.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.977 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -82.78 158.38 65.35 Favored Pre-proline 0 N--CA 1.462 0.162 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.394 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.12 -40.24 86.15 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.063 1.842 . . . . 0.0 111.831 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -85.97 -0.32 55.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.43 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -67.51 -24.99 65.63 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 111.482 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.426 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 81.9 tt0 56.27 65.72 3.97 Favored Pre-proline 0 N--CA 1.444 -0.766 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.841 -177.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.4 Cg_exo -63.08 147.34 94.43 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.736 2.291 . . . . 0.0 111.545 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -143.69 149.54 37.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.241 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.99 123.56 48.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.119 0.485 . . . . 0.0 112.154 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 mp -77.37 165.73 49.52 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.626 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -64.84 -16.17 54.03 Favored 'Trans proline' 0 C--N 1.307 -1.61 0 C-N-CA 123.245 2.63 . . . . 0.0 112.16 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 9.9 p -91.12 1.4 57.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.101 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 75.76 49.81 0.07 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.566 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -134.14 125.43 27.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.752 178.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.8 m -85.58 142.46 29.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.084 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -156.52 163.06 39.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.673 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.4 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.6 m -69.61 135.36 49.87 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.433 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.2 t -56.23 -39.8 73.09 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.634 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.97 88.38 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.7 m -67.24 -36.84 82.49 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.624 0.725 . . . . 0.0 110.215 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 73.3 mt -64.29 -35.96 82.54 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.776 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.47 -62.92 4.06 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.726 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.97 -21.4 27.89 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.512 2.142 . . . . 0.0 112.03 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.57 75.96 0.28 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.475 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.95 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.9 t0 63.45 70.19 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.945 0.402 . . . . 0.0 110.8 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.03 -8.51 38.89 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.6 p -116.16 -120.09 0.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 2.4 m -62.72 145.11 13.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.074 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 90.6 t -112.09 133.29 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.21 0.528 . . . . 0.0 111.63 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -74.22 106.42 5.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.829 0.824 . . . . 0.0 110.057 179.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.437 ' O ' ' HG2' ' A' ' 121' ' ' LYS . 7.6 t -104.05 126.99 30.21 Favored Pre-proline 0 C--O 1.202 -1.406 0 CA-C-N 114.756 -1.111 . . . . 0.0 108.63 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.32 -9.08 22.54 Favored 'Trans proline' 0 C--N 1.296 -2.226 0 CA-C-N 121.188 1.46 . . . . 0.0 113.171 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 40.5 t -85.82 -54.88 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.147 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.4 p -105.49 -27.79 11.2 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.118 0.485 . . . . 0.0 110.482 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 0.3 OUTLIER 62.05 35.9 15.7 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.209 178.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -166.74 141.84 4.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -150.22 158.75 44.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.638 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 79.2 m -96.04 -47.38 6.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.438 . . . . 0.0 110.089 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -142.61 176.45 9.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.355 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -120.87 46.74 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.374 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.23 -30.45 19.69 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.349 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -106.19 16.74 24.5 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 44.5 pt -70.95 -169.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.99 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -41.67 109.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 O-C-N 123.727 0.642 . . . . 0.0 110.075 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 163.92 -34.25 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 124.827 1.33 . . . . 0.0 111.072 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -59.59 -42.23 92.08 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 75.9 t80 37.9 73.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.965 0.79 . . . . 0.0 111.193 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.76 -50.3 74.36 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.99 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.3 ttt 178.03 -165.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.385 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.7 mtm180 -116.6 92.81 3.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.807 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.93 -36.62 79.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.922 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 121.001 0.429 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -86.74 26.59 1.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.49 0.662 . . . . 0.0 110.709 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.15 -12.1 11.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.584 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 46.3 mt -47.48 -23.8 0.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.989 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -59.66 -43.09 94.07 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.643 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.0 mt -103.96 -40.95 6.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.366 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.46 -88.28 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 164.6 -81.17 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.85 0.718 . . . . 0.0 110.891 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -102.22 168.91 9.05 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.095 0.474 . . . . 0.0 110.134 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 12.4 t -84.34 138.43 32.89 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.032 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.28 -36.41 89.55 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.584 -0.341 . . . . 0.0 113.075 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.7 t -59.61 -43.16 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.7 p -109.0 -20.53 13.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.968 0.414 . . . . 0.0 111.305 -178.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 65.62 34.26 7.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.421 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -126.42 145.69 50.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.119 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 9.6 ttm-85 -49.71 149.75 2.37 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.531 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.18 115.58 14.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.772 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -80.75 162.08 61.53 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.507 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.27 -38.08 46.41 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 121.791 1.66 . . . . 0.0 111.585 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.65 0.61 57.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.821 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -24.28 66.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.91 0.386 . . . . 0.0 111.522 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 55.92 69.0 2.04 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-O 121.289 0.566 . . . . 0.0 110.206 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.54 151.68 70.36 Favored 'Trans proline' 0 C--N 1.299 -2.027 0 C-N-CA 123.442 2.762 . . . . 0.0 111.963 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -144.87 167.01 23.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.821 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.38 126.26 51.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mp -86.63 164.68 36.39 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.278 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.46 -6.0 18.06 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.926 2.417 . . . . 0.0 112.063 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -94.33 2.34 55.83 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.333 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 76.42 39.15 0.27 Allowed 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.513 0.673 . . . . 0.0 111.222 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -134.5 120.29 19.52 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.944 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.9 m -86.56 142.83 28.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.13 167.41 29.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.882 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -71.32 136.13 47.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.6 t -53.04 -42.96 66.25 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.92 91.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.2 m -68.44 -33.58 74.45 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.659 0.742 . . . . 0.0 110.495 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 70.4 mt -63.97 -36.37 83.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.162 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.77 -65.27 2.94 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.97 -29.73 74.8 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.016 2.477 . . . . 0.0 111.551 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.69 -38.17 77.67 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.463 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.459 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.461 179.656 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.54 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.7 t0 67.89 83.84 0.16 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 110.924 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.42 -18.26 35.81 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.7 p -115.22 -120.71 0.3 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.656 -0.272 . . . . 0.0 110.318 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.0 m -63.17 142.94 16.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.936 0.398 . . . . 0.0 110.203 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 96.7 t -113.48 139.95 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.253 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.4 116.17 21.75 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.395 0.617 . . . . 0.0 109.894 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 48.9 t -106.04 133.99 19.96 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.196 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.73 -11.35 11.54 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.272 1.315 . . . . 0.0 113.302 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 15.0 t -94.59 -62.14 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.475 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.7 p -97.14 -26.55 14.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.017 0.436 . . . . 0.0 110.568 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.6 mptt 56.25 27.51 11.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.707 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -160.37 136.24 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.947 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -141.6 161.81 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.67 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 11.7 p -95.28 -43.81 7.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.363 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -143.26 177.08 8.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.896 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.99 53.53 1.07 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 111.58 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -88.65 -30.34 19.25 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.699 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -112.62 23.06 13.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.615 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 18.0 pt -70.15 -172.95 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 120.882 0.372 . . . . 0.0 111.35 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -45.25 106.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.574 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 163.87 -40.1 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 124.973 1.421 . . . . 0.0 111.106 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -89.99 72.88 7.41 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.691 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 p90 -68.14 143.56 55.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.108 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -78.38 0.57 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.395 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.0 mmm -129.42 147.11 51.21 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.616 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.6 mtm-85 -110.31 42.17 1.61 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.454 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -73.15 153.14 40.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.641 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.2 p . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.878 -179.614 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.884 0.373 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -86.38 42.54 1.0 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.653 0.739 . . . . 0.0 110.73 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.85 -13.3 23.09 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.999 -1.0 . . . . 0.0 111.366 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.3 mt -47.31 -24.58 0.79 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.411 0.444 . . . . 0.0 110.969 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -60.28 -44.35 95.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.989 0.423 . . . . 0.0 110.806 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.1 mt -103.58 -42.63 5.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.658 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.07 -90.63 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 166.22 -80.13 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.703 0.801 . . . . 0.0 111.298 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -107.59 165.42 11.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.359 0.6 . . . . 0.0 110.346 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 40.9 t -79.62 147.76 31.93 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.606 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -35.98 40.35 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.187 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 68.1 t -62.57 -37.6 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.932 0.396 . . . . 0.0 111.498 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 -26.19 10.76 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.383 -178.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 66.51 24.66 10.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.791 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -122.26 150.3 42.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.236 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -50.91 150.17 3.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.28 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.8 mt -80.59 118.41 22.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.347 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.28 165.72 16.25 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.022 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -52.56 -51.19 11.69 Favored 'Trans proline' 0 C--N 1.303 -1.862 0 C-N-CA 122.164 1.909 . . . . 0.0 112.96 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -72.14 -7.42 49.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.079 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.28 -24.34 64.86 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 121.106 -0.238 . . . . 0.0 110.919 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 49.03 71.64 1.53 Allowed Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 121.075 0.465 . . . . 0.0 110.086 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.58 148.13 82.96 Favored 'Trans proline' 0 C--N 1.295 -2.244 0 C-N-CA 122.819 2.346 . . . . 0.0 112.15 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.39 144.77 32.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.925 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.46 126.09 46.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.094 0.473 . . . . 0.0 111.104 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 mp -87.95 164.15 34.96 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.988 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -70.59 -6.77 19.78 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 C-N-CA 122.784 2.323 . . . . 0.0 112.025 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.8 p -94.56 2.52 55.66 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.509 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 74.45 41.59 0.35 Allowed 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.96 0.787 . . . . 0.0 111.074 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -134.62 118.15 16.89 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.031 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.46 135.55 33.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.242 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -149.89 167.46 26.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.512 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.3 m -71.6 135.49 46.99 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.955 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.4 t -51.63 -44.08 62.82 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.491 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.06 92.78 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.589 -0.445 . . . . 0.0 109.946 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 89.6 m -68.29 -33.53 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.698 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.14 -35.43 81.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.486 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -44.29 -64.98 1.82 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.12 -20.74 71.85 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.633 2.222 . . . . 0.0 112.137 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.99 -38.29 85.49 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.032 0.444 . . . . 0.0 109.899 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.631 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.368 -179.916 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.354 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.6 t0 64.5 77.23 0.32 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.737 0.303 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.55 -15.9 45.15 Favored Glycine 0 N--CA 1.452 -0.281 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 -179.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 80.9 p -115.58 -121.14 0.3 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.666 -0.267 . . . . 0.0 110.998 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.1 m -61.8 143.67 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 120.871 0.367 . . . . 0.0 110.052 -179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 69.5 t -110.99 137.32 43.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.479 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.72 113.44 19.7 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.608 0.718 . . . . 0.0 111.035 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 121' ' ' LYS . 42.7 t -104.11 133.78 20.05 Favored Pre-proline 0 C--N 1.312 -1.042 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.464 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.29 -10.45 8.51 Favored 'Trans proline' 0 C--N 1.301 -1.961 0 C-N-CA 121.682 1.588 . . . . 0.0 113.433 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 38.9 t -94.81 -61.82 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.939 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 13.0 p -98.12 -29.5 13.2 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 110.95 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.0 mptt 58.01 28.99 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -161.42 137.29 7.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.717 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -143.85 154.38 43.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.732 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 5.6 t -83.76 -50.05 8.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -139.25 176.98 8.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.869 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.99 45.23 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.735 0.778 . . . . 0.0 111.599 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -86.53 -19.58 29.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.414 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.59 22.63 13.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.999 0.428 . . . . 0.0 110.908 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 25.2 pt -63.71 -170.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.5 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -40.69 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 O-C-N 123.895 0.747 . . . . 0.0 110.66 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 175.38 -31.74 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 124.186 0.929 . . . . 0.0 110.79 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -84.96 71.05 10.97 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.126 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -92.66 31.14 1.4 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.938 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.38 -37.26 80.19 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.425 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 36.5 tpp -82.55 109.33 16.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.799 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.1 mtm180 -152.78 82.97 1.22 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.802 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -119.97 11.39 11.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.019 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 C--N 1.326 -0.415 0 CA-C-O 120.739 0.304 . . . . 0.0 110.241 -179.584 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 121.105 0.478 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -88.22 30.66 0.85 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.432 0.634 . . . . 0.0 110.669 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.12 -12.47 12.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.51 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.5 mt -48.5 -23.76 1.08 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.334 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.05 -42.65 90.77 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.475 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.9 mt -104.17 -39.98 6.32 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.785 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.2 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 164.94 -79.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 O-C-N 124.114 0.884 . . . . 0.0 111.045 178.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -108.03 166.92 10.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.263 0.554 . . . . 0.0 110.468 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 10.0 t -77.37 135.66 38.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.309 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.26 -38.22 94.87 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.492 -0.385 . . . . 0.0 112.779 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 72.4 t -61.41 -42.54 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.14 -16.33 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 111.074 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.28 28.8 15.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.548 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -115.6 145.28 42.83 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.915 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -52.71 149.24 6.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.447 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.71 103.19 5.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.812 -178.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -71.38 157.72 89.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.385 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -37.14 95.65 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 121.616 1.544 . . . . 0.0 110.785 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.18 0.7 55.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.209 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -67.33 -24.76 65.77 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 111.332 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.431 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 87.6 tt0 53.72 66.28 4.67 Favored Pre-proline 0 N--CA 1.438 -1.042 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.418 -177.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.9 Cg_exo -62.0 146.2 96.38 Favored 'Trans proline' 0 C--N 1.302 -1.887 0 C-N-CA 122.458 2.105 . . . . 0.0 111.906 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -138.82 142.67 38.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.541 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.6 tp -99.82 126.55 45.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.307 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 mp -83.45 165.59 39.46 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.884 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -64.74 -14.42 44.7 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 123.205 2.604 . . . . 0.0 112.502 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -92.15 1.04 57.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.15 46.72 0.09 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.04 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -131.11 119.32 21.77 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.487 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -87.1 132.53 33.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.995 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -147.25 162.37 39.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.4 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.7 m -59.52 147.56 36.41 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.27 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -60.42 -44.28 95.91 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.344 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.47 -40.63 97.28 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.901 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.9 m -67.64 -34.12 76.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.064 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.86 -36.99 85.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.155 -179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.61 -59.99 7.34 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.327 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -64.0 -16.42 54.8 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.43 2.087 . . . . 0.0 112.139 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.34 -37.58 81.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.008 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.625 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.606 179.664 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.172 -1.171 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.5 t0 75.47 81.34 0.1 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.051 0.453 . . . . 0.0 111.459 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.75 -17.34 45.97 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.26 -123.18 0.29 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.1 m -62.05 148.08 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-O 121.416 0.627 . . . . 0.0 110.715 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 88.3 t -107.57 141.52 22.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.205 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.34 135.08 34.04 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.971 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 42.0 t -122.82 134.25 24.92 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.369 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -64.91 -9.16 20.26 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 CA-C-N 120.431 1.19 . . . . 0.0 112.556 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 17.3 t -93.26 -61.27 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.326 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 29.1 p -99.51 -22.28 15.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.4 mptt 55.07 29.25 12.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.157 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -162.03 129.92 4.05 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.988 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.72 130.59 53.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.895 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 93.4 m -61.69 -47.7 84.1 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.772 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -145.2 176.8 9.26 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.465 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.3 32.18 5.17 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.017 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -86.2 -31.17 21.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.628 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -103.86 22.49 14.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.884 0.373 . . . . 0.0 111.668 -179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 41.3 pt -68.19 -169.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.775 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 131' ' ' GLU . 2.2 m -36.49 104.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 O-C-N 124.045 0.84 . . . . 0.0 110.828 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 130' ' ' VAL . 5.5 mt-10 170.79 -32.75 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 124.027 0.829 . . . . 0.0 110.362 -178.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -83.45 64.36 7.81 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.795 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -97.81 29.25 3.47 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.414 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.4 -48.01 83.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.628 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.7 tpt -77.31 119.83 21.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.23 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.8 mtm180 -123.8 35.82 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.035 0.445 . . . . 0.0 110.806 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.47 141.89 58.18 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.757 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.132 179.937 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 121.093 0.473 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 49.7 mp0 -84.0 32.42 0.48 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.475 0.655 . . . . 0.0 110.823 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -11.65 13.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.405 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.5 mt -48.36 -22.36 0.68 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.612 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -58.44 -42.37 87.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.068 0.461 . . . . 0.0 110.206 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.5 mt -104.31 -39.59 6.42 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.72 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.26 -84.1 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 166.52 -80.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.978 0.799 . . . . 0.0 110.966 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.99 170.14 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.104 0.478 . . . . 0.0 110.157 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 23.8 t -87.59 141.87 28.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.335 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.29 -39.21 92.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.653 -0.308 . . . . 0.0 112.38 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 74.9 t -61.52 -37.91 78.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -24.67 10.89 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.177 0.513 . . . . 0.0 111.116 -178.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 65.43 33.0 9.17 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.836 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -128.81 149.08 50.89 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.78 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -52.6 147.94 7.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.904 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.6 mt -72.78 116.51 13.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.001 -178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.95 161.8 72.32 Favored Pre-proline 0 N--CA 1.463 0.224 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.305 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.67 -40.26 74.95 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.083 1.856 . . . . 0.0 111.641 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -90.03 1.92 55.78 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.296 179.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.29 -24.83 66.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.669 -178.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 52.48 70.56 1.82 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-O 121.351 0.596 . . . . 0.0 109.899 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.11 153.57 67.18 Favored 'Trans proline' 0 C--N 1.294 -2.32 0 C-N-CA 122.843 2.362 . . . . 0.0 111.412 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.6 174.62 11.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.506 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -126.06 141.07 52.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.986 0.422 . . . . 0.0 111.33 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 mp -101.17 165.6 13.88 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-O 121.136 0.493 . . . . 0.0 110.897 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.51 -16.45 54.69 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.318 2.679 . . . . 0.0 112.155 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 26.7 p -86.31 -6.09 59.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.317 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 78.14 48.01 0.05 OUTLIER 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.923 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -129.98 121.74 27.13 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.295 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.4 m -87.06 138.64 31.32 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.998 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -157.92 166.69 31.98 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.127 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.7 m -68.83 139.68 55.22 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 t -56.75 -42.84 80.02 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.298 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.38 -40.41 94.22 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 97.8 m -71.01 -22.14 62.2 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.235 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 84.3 mt -81.17 -20.72 40.63 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.525 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -59.84 -53.42 46.07 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 120.556 -0.831 . . . . 0.0 111.571 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.24 -19.31 33.85 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.641 2.227 . . . . 0.0 111.779 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.99 -38.19 78.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.447 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.992 -179.947 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.9 t0 69.22 76.75 0.23 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.08 -17.68 37.54 Favored Glycine 0 N--CA 1.452 -0.236 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 82.2 p -115.11 -120.92 0.3 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.568 -0.316 . . . . 0.0 110.17 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.29 142.83 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 121.017 0.437 . . . . 0.0 110.311 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.3 t -107.17 129.84 60.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.717 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -74.29 123.76 25.17 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.964 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.478 ' O ' ' N ' ' A' ' 121' ' ' LYS . 23.4 t -106.76 129.65 24.09 Favored Pre-proline 0 C--O 1.199 -1.57 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.874 -179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -61.36 -10.22 15.28 Favored 'Trans proline' 0 C--N 1.295 -2.273 0 CA-C-N 121.715 1.648 . . . . 0.0 113.34 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.7 t -85.81 -43.73 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.394 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -120.21 -30.07 4.71 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.503 0.668 . . . . 0.0 110.307 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.9 OUTLIER 65.14 35.16 8.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.146 178.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -164.3 123.12 1.87 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.32 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.13 159.64 23.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.344 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.2 m -87.59 -55.85 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.58 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -143.52 176.82 8.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 16.0 p -101.82 27.2 6.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.022 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -88.52 -28.83 20.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.382 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -112.72 22.68 14.27 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.654 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.1 pt -86.04 -169.95 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.966 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.2 m -43.27 106.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 O-C-N 123.721 0.638 . . . . 0.0 110.248 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.64 -22.41 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 124.408 1.067 . . . . 0.0 110.864 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -97.56 22.62 8.69 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.983 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -41.2 139.29 1.0 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.416 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -161.52 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.088 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.08 144.02 50.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.947 0.403 . . . . 0.0 110.059 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -82.66 68.45 9.13 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.458 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.58 134.27 54.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.922 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.624 -179.516 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -95.26 20.5 9.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.397 0.618 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.0 -12.32 18.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.63 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.6 mt -49.01 -23.67 1.24 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.165 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -59.68 -43.5 93.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.691 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.5 mt -104.47 -41.56 5.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.599 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.74 -89.93 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 165.24 -79.03 0.0 OUTLIER 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.5 0.72 . . . . 0.0 110.836 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -99.87 167.22 10.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.117 0.484 . . . . 0.0 110.116 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 27.2 t -82.05 136.72 35.19 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.516 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -71.46 -30.07 67.26 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.72 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.1 t -61.53 -39.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.23 -17.39 11.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 0.0 111.22 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.75 38.43 9.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.791 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -129.3 144.9 51.4 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.043 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -50.71 148.89 3.64 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.426 -179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.0 mt -75.47 120.24 20.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.466 -178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -82.76 163.03 53.4 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.204 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.08 -34.09 47.93 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 121.908 1.738 . . . . 0.0 111.579 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -92.68 -2.03 56.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.389 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -66.89 -23.88 66.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.233 0.54 . . . . 0.0 111.514 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 54.72 70.34 1.7 Allowed Pre-proline 0 N--CA 1.446 -0.636 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.877 -178.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.49 149.26 80.04 Favored 'Trans proline' 0 C--N 1.3 -1.986 0 C-N-CA 123.148 2.565 . . . . 0.0 111.913 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -141.7 162.29 35.85 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.131 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.6 tp -115.44 127.69 55.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.903 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.75 164.55 36.62 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.842 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 -6.42 19.04 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.92 2.413 . . . . 0.0 112.334 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.6 p -95.38 3.95 53.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 75.22 41.21 0.3 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.521 0.677 . . . . 0.0 111.346 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -134.55 119.75 18.82 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.732 178.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.9 m -86.64 139.63 30.61 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.911 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -149.95 166.86 28.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -68.2 151.84 46.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.697 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.4 t -60.35 -47.15 87.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.337 0.589 . . . . 0.0 110.22 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.34 -40.02 96.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.135 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.81 -27.1 64.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.998 0.427 . . . . 0.0 109.85 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.34 -37.87 80.94 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.824 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.12 -61.31 5.47 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.21 -29.51 76.02 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.961 2.441 . . . . 0.0 111.682 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.45 -40.5 91.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.172 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.143 179.211 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.466 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.1 t0 68.24 82.53 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.534 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.93 -14.69 40.9 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.74 -121.44 0.3 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.341 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.2 m -62.78 143.54 15.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 122.078 -0.389 . . . . 0.0 110.482 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 98.7 t -119.34 131.06 73.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.985 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.89 141.76 53.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.204 179.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 19.2 t -139.94 132.77 15.04 Favored Pre-proline 0 N--CA 1.444 -0.733 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.484 -179.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.06 -9.59 17.58 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 121.384 1.389 . . . . 0.0 112.798 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 6.5 t -94.56 -61.04 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.4 -179.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 11.0 p -99.05 -27.13 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.782 0.325 . . . . 0.0 110.983 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.5 31.7 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -168.25 136.69 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -142.3 123.53 14.68 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.52 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 91.8 m -61.79 -44.33 97.09 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -144.12 177.18 8.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.635 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.0 63.75 0.87 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.273 0.558 . . . . 0.0 111.582 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -89.14 -30.0 18.93 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.507 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.2 23.14 13.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 111.535 -178.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 10.6 pt -64.69 -169.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.35 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -35.59 104.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 O-C-N 123.924 0.765 . . . . 0.0 110.578 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 172.54 -34.2 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 124.135 0.897 . . . . 0.0 110.599 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -83.99 70.18 10.42 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.808 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -97.39 33.0 2.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.843 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -58.65 -48.24 81.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.9 mmt -70.1 143.68 52.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.73 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -160.43 31.06 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.39 0.614 . . . . 0.0 110.501 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -98.0 162.06 13.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 90.9 p . . . . . 0 N--CA 1.453 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 -179.156 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -90.12 31.16 1.01 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.827 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.03 -12.34 25.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.443 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 38.6 mt -49.41 -23.16 1.38 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.989 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -59.24 -44.43 92.35 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.835 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.9 -41.78 5.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -162.81 -87.55 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 168.36 -80.06 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.765 0.666 . . . . 0.0 111.269 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -113.79 164.05 14.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.163 0.506 . . . . 0.0 110.149 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 13.6 t -79.41 138.58 37.68 Favored 'General case' 0 C--O 1.211 -0.929 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.851 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.67 -35.82 81.45 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.741 -0.266 . . . . 0.0 112.747 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.2 t -59.09 -43.8 90.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 9.9 p -109.5 -18.43 13.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.837 0.351 . . . . 0.0 111.587 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 64.93 30.19 12.05 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.933 178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -119.7 148.58 43.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.282 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -54.27 150.83 8.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.626 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 57.7 mt -80.48 105.54 11.81 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.696 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -80.83 167.13 34.68 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.165 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -52.29 -46.83 30.29 Favored 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 122.607 2.204 . . . . 0.0 113.033 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -82.8 0.07 45.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.204 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.21 -24.46 64.94 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 47.14 73.09 1.06 Allowed Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.283 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -68.36 147.9 72.69 Favored 'Trans proline' 0 C--N 1.299 -2.063 0 C-N-CA 122.711 2.274 . . . . 0.0 112.008 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.85 156.08 45.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.792 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.4 tp -106.88 127.33 53.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.27 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 mp -86.39 167.06 24.8 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.023 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.69 -20.32 64.86 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.984 2.456 . . . . 0.0 112.224 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 7.2 p -89.64 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.63 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 73.02 50.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.994 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 51.9 m170 -128.97 124.4 34.92 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.868 178.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -85.79 132.89 34.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -151.16 165.54 33.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.043 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -71.11 136.75 48.36 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.822 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.8 t -53.95 -43.29 69.74 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.031 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.28 -39.16 89.39 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.3 m -68.09 -33.65 74.93 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.241 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 84.9 mt -67.19 -28.76 68.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.178 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.57 -60.51 8.16 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.392 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.56 -10.34 24.02 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.633 2.222 . . . . 0.0 112.624 179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.51 -30.17 66.85 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.789 0.328 . . . . 0.0 110.219 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.334 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.449 179.625 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.511 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.1 t0 61.16 76.69 0.36 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.831 0.348 . . . . 0.0 110.915 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.77 -17.52 35.76 Favored Glycine 0 CA--C 1.519 0.298 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 77.3 p -115.83 -120.6 0.3 Allowed 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.0 137.2 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 CA-C-O 120.964 0.411 . . . . 0.0 110.525 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 96.8 t -106.48 142.41 19.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.408 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -84.87 114.73 22.32 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.478 0.656 . . . . 0.0 111.009 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.4 t -104.56 132.97 20.44 Favored Pre-proline 0 C--O 1.206 -1.229 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.216 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.11 -16.3 26.72 Favored 'Trans proline' 0 C--N 1.297 -2.15 0 C-N-CA 121.216 1.278 . . . . 0.0 112.626 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 16.4 t -96.39 -51.72 10.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.35 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -31.7 11.67 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.953 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 117' ' ' CYS . 3.0 mptt 59.46 22.82 11.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.12 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -172.8 97.86 0.13 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.233 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -89.52 145.81 25.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 0.0 110.374 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 88.5 m -61.03 -46.52 90.41 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.498 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -145.93 178.0 8.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.918 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 1.2 p -116.28 36.85 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.48 0.657 . . . . 0.0 111.64 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -89.65 -31.22 17.62 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.623 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -108.86 20.75 18.1 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.656 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 24.2 pt -71.25 -169.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.524 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -37.68 108.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 O-C-N 123.8 0.688 . . . . 0.0 110.12 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 164.74 -31.57 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 124.818 1.324 . . . . 0.0 111.321 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -93.47 85.87 5.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.958 -0.697 . . . . 0.0 111.29 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -93.19 137.38 32.57 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.909 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -94.85 -75.78 0.51 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.815 0.34 . . . . 0.0 110.51 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 28.1 ttt -146.02 142.54 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -83.93 64.98 8.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.355 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.64 122.34 13.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.173 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.792 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.78 0.324 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -90.8 28.81 1.45 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.724 0.774 . . . . 0.0 110.681 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.55 -11.99 19.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.5 mt -48.58 -23.59 1.05 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.277 179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.97 -43.35 91.32 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.0 110.594 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 69.9 mt -104.6 -41.06 5.8 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.022 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.23 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 165.45 -78.13 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.117 0 O-C-N 123.953 0.783 . . . . 0.0 110.75 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.5 p-80 -107.88 165.98 11.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 110.824 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 13.3 t -81.12 137.14 35.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.563 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.81 -37.98 93.92 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.676 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.1 t -59.93 -40.81 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 8.4 p -112.64 -18.63 12.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.943 0.401 . . . . 0.0 111.109 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.32 39.62 9.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.309 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.49 146.79 50.71 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.216 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -55.99 144.42 28.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.633 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.19 105.85 3.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.447 -179.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -79.93 165.8 44.84 Favored Pre-proline 0 C--N 1.333 -0.133 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.554 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -53.05 -43.53 56.24 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 122.432 2.088 . . . . 0.0 113.31 -177.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -88.15 2.26 52.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -66.01 -24.98 66.87 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.983 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 50.56 69.0 2.87 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 109.791 -179.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -68.9 150.81 73.72 Favored 'Trans proline' 0 C--N 1.293 -2.386 0 C-N-CA 122.628 2.219 . . . . 0.0 111.078 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.32 165.49 29.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.673 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp -114.35 130.19 56.67 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.914 0.388 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mp -90.16 164.54 27.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.242 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.51 -6.2 18.6 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.043 2.495 . . . . 0.0 112.33 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.77 0.91 55.33 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.376 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 77.65 41.54 0.13 Allowed 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 123.825 0.703 . . . . 0.0 111.338 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -135.29 119.85 18.14 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.995 178.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -86.52 141.64 28.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.9 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -157.63 166.86 31.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . 0.452 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -65.77 137.05 56.99 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.9 t -56.72 -42.19 78.76 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.069 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.27 91.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 80.8 m -66.83 -36.25 81.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.204 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 82.0 mt -66.09 -30.55 71.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.27 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.95 -62.35 4.65 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.866 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.38 -17.29 59.37 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.131 1.887 . . . . 0.0 112.05 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.01 -37.28 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.328 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.152 179.603 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.427 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.6 t0 73.03 81.65 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.783 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.31 -17.4 40.48 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 75.6 p -115.7 -122.16 0.29 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.9 m -63.3 142.91 16.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.807 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 56.4 t -113.63 140.72 32.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.421 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -87.74 129.25 35.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.537 0.684 . . . . 0.0 109.913 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.482 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.0 t -116.12 131.41 23.78 Favored Pre-proline 0 C--O 1.195 -1.765 0 CA-C-N 114.805 -1.088 . . . . 0.0 108.226 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -59.6 -11.5 14.44 Favored 'Trans proline' 0 C--N 1.295 -2.25 0 CA-C-N 121.502 1.572 . . . . 0.0 113.176 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.4 t -84.01 -44.82 18.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.541 -0.463 . . . . 0.0 111.7 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.55 -30.69 5.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.02 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.2 OUTLIER 64.24 31.44 13.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.073 178.581 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -162.72 139.43 7.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.996 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -143.05 161.49 38.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.077 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 80.4 m -96.48 -43.16 7.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.998 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -142.34 175.05 10.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.251 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -125.06 42.71 3.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.336 0.588 . . . . 0.0 111.217 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -85.75 -15.45 42.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.031 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -114.33 22.48 13.69 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.6 pt -69.12 -173.65 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.774 0.321 . . . . 0.0 111.144 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.3 m -45.47 105.61 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.284 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.572 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 168.26 -32.16 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 124.152 0.908 . . . . 0.0 110.576 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -93.31 64.95 3.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.154 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -60.83 139.37 57.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.394 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -93.56 -72.95 0.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.485 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.7 ttt -150.79 144.86 25.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.596 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -122.48 99.69 6.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -135.75 34.6 2.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.696 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.439 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.1 mp0 -94.41 30.26 2.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.77 0.795 . . . . 0.0 110.148 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.8 -11.98 15.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.447 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.8 mt -47.51 -24.07 0.77 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.309 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -58.98 -41.74 88.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.331 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 mp -104.42 -40.91 5.9 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.934 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.55 -85.49 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 164.7 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 O-C-N 124.136 0.898 . . . . 0.0 110.905 178.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.88 162.37 14.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.306 0.574 . . . . 0.0 110.699 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 30.5 t -73.31 134.9 44.31 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.544 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.5 -30.07 71.28 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.775 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.1 t -64.11 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.06 -15.47 11.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 110.972 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.33 41.09 8.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.254 0.55 . . . . 0.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -126.19 144.97 50.57 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.196 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -52.57 151.98 3.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.64 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.3 mt -85.87 102.28 13.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.017 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -75.9 160.22 79.14 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.854 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -57.59 -33.16 96.15 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.161 1.907 . . . . 0.0 111.319 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -89.03 -8.17 54.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.449 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -67.78 -24.33 65.31 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.911 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 51.09 73.6 0.95 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.479 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.04 149.43 71.49 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.706 2.27 . . . . 0.0 111.739 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -141.54 141.58 33.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.306 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.8 tp -92.65 129.22 38.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.47 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -85.59 165.37 35.81 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.27 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -62.68 -18.33 63.5 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.175 2.583 . . . . 0.0 112.34 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.64 2.7 55.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.103 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.7 47.68 0.12 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.206 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -133.91 124.75 26.94 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.472 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.9 m -85.06 138.49 32.4 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.987 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -147.98 160.88 42.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.314 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 6.3 m -62.67 151.83 37.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.5 t -58.74 -47.56 84.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.985 0.422 . . . . 0.0 110.582 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.79 -42.44 95.05 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.817 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.8 m -67.07 -23.72 65.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.204 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.56 -32.11 73.62 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.126 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.49 -65.14 3.44 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -64.37 110.5 1.4 Allowed 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.689 2.26 . . . . 0.0 111.492 179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 169.56 -71.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.629 0.581 . . . . 0.0 110.057 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.559 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.919 179.59 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.501 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.37 73.55 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.026 0.441 . . . . 0.0 110.628 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 102.98 -13.44 56.06 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.0 p -114.68 -118.94 0.31 Allowed 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.7 m -61.3 141.83 16.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 -179.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.5 t -107.74 134.01 50.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.117 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -81.37 108.66 15.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.968 0.889 . . . . 0.0 110.54 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 121' ' ' LYS . 36.6 t -95.83 131.76 28.55 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.787 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.97 -12.07 14.21 Favored 'Trans proline' 0 C--N 1.297 -2.147 0 C-N-CA 121.003 1.136 . . . . 0.0 112.771 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.44 -61.58 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.504 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 9.3 p -98.7 -25.35 14.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.953 0.406 . . . . 0.0 110.85 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.7 mptt 55.74 32.66 19.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -165.27 137.47 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.03 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -144.6 142.08 29.9 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 98.7 m -70.86 -44.63 66.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.011 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -145.49 178.07 8.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.711 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.54 48.86 1.52 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.481 0.658 . . . . 0.0 111.516 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.01 -29.7 21.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.282 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -103.86 20.49 18.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.904 0.383 . . . . 0.0 111.392 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.6 pt -62.9 -168.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -35.31 116.5 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 O-C-N 124.054 0.846 . . . . 0.0 110.437 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 161.63 -32.52 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.465 0 O-C-N 124.986 1.429 . . . . 0.0 110.013 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -85.59 60.02 5.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.228 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -97.25 28.59 3.56 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.473 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -59.48 -48.04 83.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.6 mmt -78.83 121.1 24.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.237 0.541 . . . . 0.0 110.844 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -153.35 104.34 2.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.22 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -108.4 -80.93 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.133 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 18.6 p . . . . . 0 C--N 1.333 -0.117 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.339 179.634 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.065 0.46 . . . . 0.0 109.799 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.96 19.82 1.31 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.093 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.81 -12.67 7.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.632 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 44.3 mt -47.93 -24.02 0.93 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.461 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -59.39 -41.58 89.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.067 0.46 . . . . 0.0 110.382 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -104.0 -40.43 6.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.869 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.35 -86.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 164.29 -78.95 0.0 OUTLIER 'General case' 0 CA--C 1.527 0.064 0 O-C-N 124.037 0.835 . . . . 0.0 110.823 179.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -106.17 163.09 13.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.315 0.579 . . . . 0.0 110.72 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -76.73 135.1 39.02 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.216 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.86 -37.94 94.93 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.634 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.41 -40.32 83.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -176.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 7.7 p -113.07 -17.79 12.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.956 0.408 . . . . 0.0 110.939 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.23 41.31 8.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.368 179.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -129.76 147.8 51.57 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.161 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.8 tpp85 -54.26 144.74 19.39 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.941 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.9 mt -75.53 102.85 5.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.24 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -78.83 164.28 56.13 Favored Pre-proline 0 C--N 1.331 -0.207 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.86 -48.28 17.23 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 C-N-CA 121.44 1.427 . . . . 0.0 112.668 -178.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -72.2 -4.87 31.89 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.968 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -67.34 -25.14 65.85 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.777 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 51.78 72.11 1.3 Allowed Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.255 -178.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.81 148.2 76.57 Favored 'Trans proline' 0 C--N 1.297 -2.157 0 C-N-CA 122.711 2.274 . . . . 0.0 112.102 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -139.52 160.89 38.8 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.161 -178.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.2 tp -115.31 127.85 55.71 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.013 0.435 . . . . 0.0 111.019 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.3 mp -87.39 164.59 34.75 Favored Pre-proline 0 N--CA 1.467 0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.097 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.57 -6.67 19.63 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 123.061 2.508 . . . . 0.0 112.408 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -94.5 0.1 55.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 78.33 41.67 0.11 Allowed 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.947 0.779 . . . . 0.0 111.221 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 33.8 m170 -134.79 123.94 24.36 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.515 178.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.5 m -86.83 143.49 27.45 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.828 -0.749 . . . . 0.0 109.719 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -150.49 164.48 35.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.992 -179.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 21.1 m -66.85 151.08 48.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.181 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.3 p -61.8 -42.24 98.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.616 0.722 . . . . 0.0 109.878 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.46 95.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.268 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.92 -31.85 69.83 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.775 0.798 . . . . 0.0 109.963 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.46 -37.14 86.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.429 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.64 -62.31 4.94 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 120.508 -0.853 . . . . 0.0 111.203 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.21 -22.6 66.89 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 122.08 1.854 . . . . 0.0 111.467 179.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.65 -38.9 82.67 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.934 179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.473 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.962 178.969 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.605 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.6 t0 74.57 83.24 0.11 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.895 0.409 . . . . 0.0 111.957 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.3 -9.44 45.78 Favored Glycine 0 CA--C 1.519 0.294 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.1 t -116.69 -118.57 0.32 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.33 151.53 4.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.358 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.7 t -112.71 135.36 52.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.099 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -77.62 104.22 8.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.55 0.69 . . . . 0.0 109.553 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 121' ' ' LYS . 13.1 t -100.13 116.99 64.02 Favored Pre-proline 0 C--O 1.204 -1.296 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.637 -179.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -53.2 -16.06 6.24 Favored 'Trans proline' 0 C--N 1.297 -2.142 0 CA-C-N 121.068 1.417 . . . . 0.0 113.47 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 23.3 t -79.03 -62.11 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.742 -178.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.8 p -99.73 -29.13 12.82 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.463 0.649 . . . . 0.0 109.826 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.429 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.4 OUTLIER 63.94 33.1 12.69 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.22 178.78 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -164.63 138.6 5.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.998 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -145.4 165.57 28.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.993 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.3 m -95.92 -50.99 4.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.357 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -142.45 176.24 9.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.736 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.37 34.48 4.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.428 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.5 ptmt -77.18 -22.53 52.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.21 22.3 14.91 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.448 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.403 HG23 HD13 ' A' ' 129' ' ' ILE . 45.5 pt -65.98 -168.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -36.39 115.32 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 O-C-N 124.066 0.854 . . . . 0.0 110.666 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 164.19 -31.76 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 124.914 1.384 . . . . 0.0 109.871 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -86.14 60.19 6.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.934 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -91.31 36.96 0.93 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.712 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.87 -48.4 81.52 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.235 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.0 mmt -84.49 139.32 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.071 0.462 . . . . 0.0 111.029 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -148.35 48.58 1.04 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.508 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.07 159.28 15.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.534 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.3 p . . . . . 0 C--N 1.33 -0.272 0 CA-C-O 120.821 0.344 . . . . 0.0 110.949 -179.623 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.597 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 155.06 -164.99 32.08 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.2 140.33 41.67 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -89.39 37.42 0.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 110.504 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.44 -12.32 30.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.773 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.5 mt -49.66 -23.11 1.56 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.125 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -59.46 -44.26 93.03 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.872 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 71.5 mt -104.74 -41.28 5.7 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.621 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.56 -88.04 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 167.33 -78.92 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.081 0 O-C-N 123.706 0.629 . . . . 0.0 110.92 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -114.12 167.02 11.04 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.243 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 3.5 t -78.24 135.29 37.55 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.49 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.06 -38.71 94.29 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 121.564 -0.35 . . . . 0.0 113.068 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.08 -43.35 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.2 p -107.11 -18.74 13.81 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.865 0.364 . . . . 0.0 111.605 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.47 40.28 8.42 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.294 0.568 . . . . 0.0 110.491 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -130.84 146.77 52.37 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.175 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -52.17 149.23 5.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.601 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.6 mt -79.57 105.83 11.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.714 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -85.39 167.25 26.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.94 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.69 -51.57 10.82 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.476 1.451 . . . . 0.0 112.625 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.25 -5.03 33.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.522 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -66.67 -26.12 66.89 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.838 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 46.71 70.06 2.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 O-C-N 123.584 0.553 . . . . 0.0 109.614 -178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.18 145.06 77.47 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.923 2.415 . . . . 0.0 111.697 -178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -141.93 143.72 33.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.37 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.94 123.51 45.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.839 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.5 mp -83.55 168.19 23.81 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.605 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -68.17 -14.57 40.96 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 123.154 2.569 . . . . 0.0 112.28 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.2 p -88.48 -0.77 57.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.237 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 75.52 46.37 0.11 Allowed 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 123.832 0.708 . . . . 0.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -134.12 117.53 16.68 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.881 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.0 m -87.59 141.45 28.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.096 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -156.88 164.59 37.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.805 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.431 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -62.95 137.22 58.21 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.556 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -56.38 -43.18 79.0 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.042 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.1 92.51 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.471 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.2 m -67.26 -33.56 75.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.29 0.567 . . . . 0.0 110.308 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 90.4 mt -68.81 -28.64 66.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.64 -62.3 6.36 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.562 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.27 -19.35 42.06 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 123.071 2.514 . . . . 0.0 111.758 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.63 77.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.577 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.66 144.12 51.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.455 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.96 156.43 38.79 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 122.349 2.033 . . . . 0.0 112.422 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.56 134.73 37.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.434 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 47.5 30.78 1.74 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.636 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -152.4 156.0 38.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.712 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -152.72 168.15 26.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.1 t -159.0 145.75 17.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.618 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 64.6 m 51.57 44.14 29.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.79 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -99.67 117.79 5.98 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -62.56 -39.57 94.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.822 0.344 . . . . 0.0 110.615 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.25 163.65 33.0 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.04 -130.23 50.71 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -128.64 141.82 51.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.755 0.312 . . . . 0.0 110.393 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.77 136.89 52.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.792 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 89.26 168.45 43.64 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.8 t0 68.68 82.93 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.788 0.328 . . . . 0.0 110.721 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.39 -17.1 37.4 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -116.16 -119.33 0.31 Allowed 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.4 m -63.17 152.72 7.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.962 0.41 . . . . 0.0 110.096 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 82.8 t -127.98 142.06 44.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.745 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -80.52 125.41 29.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.636 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.7 135.47 19.77 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.331 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.68 -11.14 10.84 Favored 'Trans proline' 0 C--N 1.303 -1.868 0 CA-C-N 120.613 1.255 . . . . 0.0 112.939 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 22.3 t -94.35 -60.86 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.574 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.8 p -98.42 -26.37 14.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.975 0.416 . . . . 0.0 110.543 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mptt 57.64 35.24 25.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.978 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.66 144.81 4.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.918 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.04 153.68 40.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.659 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 92.7 m -95.69 -44.55 7.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.181 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -142.47 160.12 40.9 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.31 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.88 27.02 7.42 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.577 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -61.55 -41.46 97.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.452 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -105.32 16.37 25.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.327 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.57 -176.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.133 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.6 m -38.76 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.956 0.785 . . . . 0.0 109.762 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 161.97 -21.31 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.894 1.371 . . . . 0.0 111.244 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -106.89 30.46 6.11 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.978 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -42.43 118.42 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.321 0.581 . . . . 0.0 111.314 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -63.45 -51.92 63.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 171.03 -168.53 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.395 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -115.82 92.46 3.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.878 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.34 -10.01 55.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.007 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.9 p -64.64 156.88 28.7 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.782 0.325 . . . . 0.0 110.4 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -176.03 142.73 6.18 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 67.1 m 49.12 40.72 18.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.742 0.306 . . . . 0.0 110.564 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -93.48 124.2 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.17 148.36 27.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.0 -40.37 95.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 70.5 p -78.38 164.04 25.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.576 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.691 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.84 -39.92 98.13 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.99 140.31 57.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.751 0.31 . . . . 0.0 110.297 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -90.23 20.3 4.48 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.403 0.62 . . . . 0.0 111.172 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.52 -12.2 14.21 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.672 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 47.5 mt -49.61 -23.4 1.67 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.281 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -59.66 -42.28 92.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.014 0.435 . . . . 0.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.96 -40.14 6.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.718 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -85.53 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 167.1 -80.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 O-C-N 123.98 0.8 . . . . 0.0 110.649 179.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -109.24 164.67 12.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.55 0.69 . . . . 0.0 110.714 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 24.1 t -80.22 136.27 36.43 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.092 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.06 -35.6 89.34 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.399 -0.364 . . . . 0.0 112.727 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.75 -39.35 79.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -177.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.4 p -116.59 -17.43 10.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.487 . . . . 0.0 111.409 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.98 40.23 7.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.586 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.99 147.21 50.49 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.161 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -54.26 149.36 9.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.64 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.2 mt -79.73 109.46 14.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.92 -178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -73.51 161.41 79.09 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.451 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -57.79 -40.25 80.52 Favored 'Trans proline' 0 N--CA 1.495 1.571 0 C-N-CA 122.261 1.974 . . . . 0.0 111.742 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -89.68 1.25 56.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.223 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.16 -24.8 65.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.943 0.401 . . . . 0.0 111.681 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 54.3 71.76 1.27 Allowed Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.137 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.0 152.26 57.03 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 C-N-CA 122.752 2.302 . . . . 0.0 111.085 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.75 166.95 23.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.307 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 tp -118.43 126.78 52.79 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 mp -85.67 168.53 19.35 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -67.08 -15.71 47.31 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 123.332 2.688 . . . . 0.0 112.538 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 11.2 p -93.44 1.12 56.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.4 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.02 51.51 0.11 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.38 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 56.2 m170 -128.07 121.46 29.73 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.51 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -87.6 132.37 34.09 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.235 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -150.22 162.04 41.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.803 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 4.0 m -66.51 136.55 55.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -56.57 -42.06 77.96 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.573 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.96 91.59 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.1 m -68.19 -32.99 73.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.239 0.542 . . . . 0.0 110.009 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 93.7 mt -70.78 -26.67 63.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.849 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.66 -60.0 9.78 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.8 -0.715 . . . . 0.0 111.751 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.31 -16.36 34.15 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.95 2.434 . . . . 0.0 111.993 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.3 -38.47 80.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.679 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.88 146.29 99.0 Favored Pre-proline 0 CA--C 1.535 0.385 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.216 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.31 -21.37 31.03 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.47 2.113 . . . . 0.0 112.664 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 59.36 35.1 23.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.519 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 67.54 31.55 6.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.683 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -119.31 7.88 11.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.013 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -150.64 125.06 9.52 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.224 0.535 . . . . 0.0 111.155 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 82.2 p -72.13 163.49 27.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.429 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.8 t -109.25 122.53 47.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.869 0.366 . . . . 0.0 110.482 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -66.82 131.02 31.09 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 51.59 28.61 4.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.764 0.316 . . . . 0.0 110.378 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -112.4 -169.85 18.06 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.93 -41.16 99.22 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 176.2 -56.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.925 0.393 . . . . 0.0 110.724 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.58 162.28 40.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.51 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -77.74 -145.0 2.27 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.5 t0 77.38 87.23 0.08 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.018 0.437 . . . . 0.0 111.37 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.36 -18.09 39.24 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.6 t -116.81 -122.84 0.29 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.45 149.38 9.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.113 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.4 t -123.49 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.729 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -67.37 92.01 0.28 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.661 0.743 . . . . 0.0 109.688 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 9.1 t -75.33 132.79 75.48 Favored Pre-proline 0 C--O 1.212 -0.89 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.845 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.98 -14.13 35.4 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 120.803 1.322 . . . . 0.0 112.531 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 6.6 t -94.75 -50.37 11.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.296 -0.562 . . . . 0.0 112.414 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.57 -29.27 10.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.377 0.608 . . . . 0.0 110.095 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 57.48 29.51 17.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.828 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -170.31 100.76 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.523 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -100.47 143.48 30.61 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.175 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.43 -54.29 25.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.564 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -145.18 171.69 14.17 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.121 0.486 . . . . 0.0 110.798 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 13.7 p -93.57 8.78 39.44 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.552 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.87 -40.95 97.74 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.474 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -101.17 9.86 41.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.627 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -86.15 -172.1 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.655 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.6 m -39.32 104.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 O-C-N 123.504 0.503 . . . . 0.0 110.983 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 162.86 -25.02 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 125.022 1.451 . . . . 0.0 110.56 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -104.6 57.55 0.7 Allowed 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.43 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 6.4 p90 -52.38 141.37 19.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.302 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -102.18 -74.97 0.61 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.368 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.1 ttt -151.26 144.43 24.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.726 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -83.92 62.63 7.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.837 0.351 . . . . 0.0 110.182 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -61.5 139.8 58.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.157 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 6.0 p 176.72 -26.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 124.49 -49.91 0.88 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 72.1 m -63.49 -39.97 95.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.183 0.516 . . . . 0.0 110.253 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -101.58 125.82 48.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.711 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.63 150.97 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.429 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -64.53 137.43 57.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 67.4 p -71.42 -26.31 62.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.708 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.681 -179.788 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.599 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.3 -41.81 99.73 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.031 -0.827 . . . . 0.0 111.031 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.91 130.67 35.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.832 0.349 . . . . 0.0 110.19 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -89.33 21.34 3.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.253 0.549 . . . . 0.0 110.947 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.12 -12.23 18.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.674 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.5 mt -49.73 -22.31 1.35 Allowed 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.222 179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.02 -44.45 91.73 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.822 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 mt -104.81 -41.47 5.63 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.513 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.34 -89.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 165.41 -79.99 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.107 0 O-C-N 123.879 0.737 . . . . 0.0 110.799 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -106.42 165.74 11.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.181 0.515 . . . . 0.0 110.319 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 18.9 t -80.02 137.03 36.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.764 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.08 -34.99 82.8 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 121.658 -0.306 . . . . 0.0 112.796 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.99 -42.32 89.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.1 p -111.25 -18.6 12.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.975 0.417 . . . . 0.0 111.234 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 64.17 38.56 8.16 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -128.03 144.32 51.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.207 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 149.37 2.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.395 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.0 mt -78.97 106.9 11.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.641 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.05 157.98 86.28 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.52 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.82 -38.45 95.8 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 121.985 1.79 . . . . 0.0 111.369 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -87.92 -0.59 57.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.308 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.55 -24.67 65.55 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 120.742 0.306 . . . . 0.0 111.703 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 56.56 70.02 1.58 Allowed Pre-proline 0 N--CA 1.442 -0.842 0 CA-C-O 121.405 0.621 . . . . 0.0 109.943 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.91 147.6 74.8 Favored 'Trans proline' 0 C--N 1.301 -1.948 0 C-N-CA 123.052 2.501 . . . . 0.0 111.485 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 mtm-85 -138.02 161.24 37.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.587 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.5 tp -116.97 124.77 50.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.037 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.2 mp -87.99 162.8 39.89 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.414 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.74 -8.9 24.79 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 123.066 2.511 . . . . 0.0 112.419 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 22.1 p -92.44 2.42 56.68 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.067 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 73.9 41.68 0.4 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.488 0.661 . . . . 0.0 110.989 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -133.32 118.79 18.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.4 m -86.89 139.06 31.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.09 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -151.66 165.19 35.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.848 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.415 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -70.88 139.35 50.77 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -54.65 -43.41 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.237 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -40.08 92.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.6 m -67.78 -34.73 77.36 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.49 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 82.1 mt -64.93 -31.46 72.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.974 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.7 -63.07 4.4 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.469 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.25 -15.2 46.72 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 122.484 2.122 . . . . 0.0 112.321 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.51 -36.3 75.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.519 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.22 123.0 87.86 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.323 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.52 155.82 58.95 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.072 1.848 . . . . 0.0 112.454 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -144.89 155.53 43.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 133.24 55.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 0.0 110.525 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.46 -40.32 96.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.791 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -113.38 151.67 30.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.649 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 48.2 t -60.49 -42.6 96.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.428 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 82.7 p -69.85 161.29 30.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.642 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -89.78 12.36 67.51 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -60.28 -39.53 87.2 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.677 0.275 . . . . 0.0 110.707 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -96.82 146.24 18.2 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.85 163.2 54.89 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.66 154.05 39.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.846 0.355 . . . . 0.0 110.586 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -115.97 145.35 43.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.529 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 60.24 -129.26 47.38 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 t0 70.87 74.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.848 0.356 . . . . 0.0 110.937 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.17 -17.43 37.61 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -178.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 66.7 p -115.44 -119.31 0.31 Allowed 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.484 0.183 . . . . 0.0 110.513 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.3 m -59.13 141.97 15.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.214 0.531 . . . . 0.0 110.516 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.9 139.62 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.591 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -84.58 108.18 17.2 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.331 0.586 . . . . 0.0 110.281 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 1.6 t -96.61 135.92 22.05 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.414 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -55.16 -18.05 16.78 Favored 'Trans proline' 0 C--N 1.297 -2.144 0 C-N-CA 121.072 1.181 . . . . 0.0 112.86 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.64 -63.09 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.006 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 22.4 p -87.62 -28.44 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.86 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 50.53 25.0 1.79 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.851 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -166.53 122.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.845 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -123.91 143.09 50.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.732 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 50.8 t -63.47 -51.08 67.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.907 0.384 . . . . 0.0 110.721 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -146.4 176.02 10.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.341 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 59.5 p -108.04 53.56 0.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.775 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -87.42 -40.39 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.742 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.5 22.82 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 111.581 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.7 pt -62.87 -171.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -37.9 109.43 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 O-C-N 123.901 0.751 . . . . 0.0 110.393 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 167.96 -30.78 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 124.793 1.308 . . . . 0.0 111.014 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -84.88 72.65 10.75 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 120.296 -0.561 . . . . 0.0 111.068 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -93.39 26.93 2.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -59.93 -47.78 84.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.942 0.401 . . . . 0.0 110.514 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.4 tpt -73.95 125.96 29.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.812 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -144.62 96.35 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.818 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -124.23 144.44 49.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.605 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 p -177.56 -75.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.917 0.389 . . . . 0.0 111.007 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -99.03 73.09 0.53 Allowed Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 13.5 p 51.51 34.27 12.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.796 0.331 . . . . 0.0 110.294 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -82.0 105.63 13.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.617 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -71.03 148.45 47.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.671 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -121.03 141.8 50.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.572 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 89.8 m -66.29 130.29 42.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.499 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.536 179.902 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.636 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.45 119.09 4.56 Favored Glycine 0 CA--C 1.521 0.416 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.4 144.38 53.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.912 0.387 . . . . 0.0 110.202 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -87.94 22.08 2.48 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.555 0.693 . . . . 0.0 111.051 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.77 -12.22 16.0 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.777 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 44.2 mt -49.46 -22.97 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.181 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.71 -42.9 94.07 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.535 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.92 -40.29 6.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.639 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.28 -86.6 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 166.94 -78.38 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 O-C-N 123.906 0.754 . . . . 0.0 110.904 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -106.71 164.58 11.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.351 0.596 . . . . 0.0 110.438 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.2 t -80.94 137.11 36.12 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.869 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.35 -36.11 88.72 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 121.778 -0.248 . . . . 0.0 112.799 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 61.5 t -59.46 -40.04 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 5.6 p -114.19 -18.3 11.66 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.915 0.388 . . . . 0.0 111.128 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 64.14 38.35 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.347 0.594 . . . . 0.0 110.664 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -127.14 144.4 51.04 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.844 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -51.87 150.87 3.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.715 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.3 mt -78.02 105.11 9.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.298 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -79.24 166.89 38.74 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.94 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.31 -47.82 24.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.046 1.831 . . . . 0.0 112.982 -177.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -82.2 2.8 29.98 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.508 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -63.94 -25.76 68.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.311 -178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.436 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 79.3 tt0 50.73 65.96 6.08 Favored Pre-proline 0 N--CA 1.446 -0.66 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.581 -178.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.436 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 22.6 Cg_exo -62.48 150.19 88.33 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 123.161 2.574 . . . . 0.0 112.279 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mtt85 -149.66 147.24 27.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.155 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.04 114.37 28.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.924 0.392 . . . . 0.0 111.264 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -66.37 165.25 24.58 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 121.066 0.46 . . . . 0.0 110.944 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -63.63 -14.71 44.32 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 C-N-CA 123.091 2.527 . . . . 0.0 112.392 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 18.5 p -90.5 2.87 55.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.352 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 75.41 47.94 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.835 0.71 . . . . 0.0 111.373 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -129.95 121.16 26.03 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.649 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -86.77 133.29 33.67 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.122 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.13 167.15 30.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.646 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -69.11 149.73 48.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.342 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -58.88 -44.43 91.12 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.077 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.45 97.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.881 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.3 m -70.0 -28.05 65.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.658 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.09 -34.31 74.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.375 179.478 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.1 -57.97 10.39 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.97 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.92 -11.87 23.27 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.053 1.836 . . . . 0.0 112.832 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.44 80.15 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.014 0.435 . . . . 0.0 110.395 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -93.44 147.39 33.61 Favored Pre-proline 0 C--O 1.236 0.392 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.788 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.85 -34.15 24.79 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.056 1.837 . . . . 0.0 112.423 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.96 -44.88 94.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.598 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.79 -41.79 97.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.622 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.19 158.81 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.656 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -84.45 102.59 12.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.319 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.7 t -65.26 137.43 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 70.1 m -89.57 154.11 20.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.51 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 84.17 -169.49 45.97 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.48 102.5 14.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 179.75 170.84 41.98 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.05 21.5 78.36 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.981 -0.847 . . . . 0.0 110.981 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.42 135.77 57.16 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.549 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 47.1 29.64 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.683 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -86.61 -155.46 27.08 Favored Glycine 0 CA--C 1.521 0.451 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.3 t0 73.43 82.38 0.12 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.013 0.435 . . . . 0.0 111.774 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.29 -18.65 35.63 Favored Glycine 0 C--N 1.332 0.332 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.2 t -117.67 -119.99 0.31 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.307 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.2 m -61.21 155.32 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.941 0.4 . . . . 0.0 110.893 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 73.8 t -119.78 140.1 44.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -84.97 109.3 18.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.811 0.815 . . . . 0.0 111.165 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.1 t -103.5 130.95 22.57 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 114.385 -1.28 . . . . 0.0 109.552 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -55.15 -15.4 10.58 Favored 'Trans proline' 0 C--N 1.302 -1.878 0 C-N-CA 121.236 1.291 . . . . 0.0 112.956 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.3 t -92.49 -62.54 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.34 -0.544 . . . . 0.0 112.148 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.6 p -95.49 -26.38 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.565 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 mptt 53.93 24.56 4.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.674 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 tm0? -162.82 128.61 3.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.607 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -136.59 139.06 41.86 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 53.0 t -61.44 -49.4 76.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 110.295 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -145.04 177.06 9.04 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.415 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 3.8 p -122.29 48.37 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.278 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -87.15 -22.9 25.04 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.992 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -109.13 18.34 20.67 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.872 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.8 pt -64.06 -169.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.812 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 m -39.05 104.32 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.281 0 O-C-N 123.867 0.729 . . . . 0.0 110.237 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 162.91 -13.24 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 124.735 1.272 . . . . 0.0 111.427 -178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -90.85 20.33 4.87 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 119.752 -0.779 . . . . 0.0 111.116 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -42.09 105.77 0.05 Allowed 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.54 0.525 . . . . 0.0 110.952 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -85.05 -74.4 0.4 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 55.0 ttp -152.83 148.61 27.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 78.3 mtm-85 -86.28 65.6 9.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.141 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -55.41 125.27 20.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.783 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 p -179.54 96.63 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.781 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 67.88 24.33 74.3 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 62.9 m 57.26 19.38 4.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.695 0.283 . . . . 0.0 110.643 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.95 -40.08 91.01 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.909 0.385 . . . . 0.0 110.862 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -71.07 149.26 46.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.861 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 60.96 45.73 9.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.583 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 98.1 m -63.57 131.0 46.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.576 -179.694 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.713 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.95 99.87 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.22 139.38 58.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 0.0 110.585 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.84 20.23 4.94 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.499 0.666 . . . . 0.0 110.651 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -11.68 14.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.819 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.8 mt -48.27 -23.51 0.91 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.894 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.53 -44.01 93.29 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.713 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 mt -104.44 -41.83 5.63 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.716 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.81 -89.99 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 165.27 -67.72 0.0 OUTLIER 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.93 0.769 . . . . 0.0 111.455 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -118.11 163.85 16.01 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.271 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 5.3 t -81.51 140.04 34.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.993 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.27 -38.65 93.92 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.334 -0.46 . . . . 0.0 113.283 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -59.96 -44.07 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 26.7 p -106.33 -20.38 13.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.931 0.396 . . . . 0.0 111.582 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 65.04 36.03 7.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.503 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.11 146.5 50.68 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.379 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.0 tpp180 -52.02 148.64 5.86 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.466 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.6 mt -73.43 101.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.244 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -71.4 166.94 34.3 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.753 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -55.39 -43.1 61.64 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.267 1.978 . . . . 0.0 113.172 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -87.06 2.7 48.84 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.431 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -64.68 -25.66 68.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.677 0.275 . . . . 0.0 111.333 -178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 47.8 68.92 3.04 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.809 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -66.98 140.77 55.75 Favored 'Trans proline' 0 C--N 1.298 -2.122 0 C-N-CA 122.971 2.447 . . . . 0.0 111.791 -178.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -135.22 145.55 47.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.583 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 tp -100.29 122.18 42.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 mp -81.31 166.31 39.15 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.82 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -61.93 -16.68 51.2 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 123.015 2.476 . . . . 0.0 112.139 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.7 p -88.49 -1.22 57.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.403 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.27 45.66 0.19 Allowed 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 123.758 0.661 . . . . 0.0 110.998 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -129.71 122.23 28.5 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.443 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -86.52 138.06 32.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.217 -179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -153.46 165.64 35.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.731 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -68.73 138.77 55.16 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -56.28 -42.5 77.58 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.025 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.07 92.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 87.1 m -65.81 -36.39 83.36 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.156 0.503 . . . . 0.0 110.349 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 92.0 mt -66.72 -29.66 69.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.173 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.32 -60.67 6.06 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.79 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.57 -16.5 55.02 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.188 1.925 . . . . 0.0 112.452 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.58 -24.59 65.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.655 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -116.5 88.38 23.85 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -78.42 122.16 5.49 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.513 2.142 . . . . 0.0 112.756 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.12 96.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.952 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 50.4 28.99 3.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.546 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.79 88.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.564 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.35 -40.22 89.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.756 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.9 t -148.66 130.09 14.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.4 m -64.22 -40.6 96.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.568 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 93.25 145.54 17.42 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -62.75 -44.61 95.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.85 0.357 . . . . 0.0 110.367 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.0 160.47 34.05 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.66 85.98 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -104.71 25.73 9.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 110.462 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.94 85.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.473 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.74 113.5 3.98 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -177.42 58.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.09 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 101.82 -15.96 56.47 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 -179.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 81.3 p -107.07 -121.23 0.24 Allowed 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.289 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 26.5 m -60.5 141.72 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-O 121.137 0.494 . . . . 0.0 109.94 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 50.6 t -107.47 131.12 58.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.581 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 49.4 p-10 -79.29 84.54 5.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.072 0.939 . . . . 0.0 109.901 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.61 137.08 77.37 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.822 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -55.34 -18.69 19.57 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 CA-C-N 120.21 1.111 . . . . 0.0 113.182 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.7 t -95.58 -63.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.479 -0.489 . . . . 0.0 112.202 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 20.7 p -86.6 -28.76 23.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.678 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 49.55 26.14 1.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.975 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -165.31 119.82 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.592 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -123.33 171.19 9.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.621 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 96.1 m -94.78 -51.94 4.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.478 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -145.02 174.98 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.606 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 64.8 p -108.43 50.12 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.054 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.05 -38.75 15.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.567 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.13 19.09 20.88 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.871 0.367 . . . . 0.0 111.774 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 8.6 pt -61.41 -170.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.731 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.3 m -38.89 105.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 O-C-N 123.817 0.698 . . . . 0.0 110.547 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 174.91 -34.21 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.583 0 O-C-N 124.286 0.991 . . . . 0.0 110.812 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -84.51 72.53 10.63 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.815 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -68.76 138.14 54.61 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.936 0.398 . . . . 0.0 111.161 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -107.46 -177.09 3.25 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.39 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 98.2 mtp -62.0 149.53 40.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.233 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -79.37 59.3 2.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.201 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -62.05 117.43 5.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.321 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 85.1 p -165.51 173.0 11.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.693 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -57.99 -34.87 73.72 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 71.9 m -60.33 -39.02 85.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.978 0.418 . . . . 0.0 110.509 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -81.6 139.71 34.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.53 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -158.47 164.2 36.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.8 88.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 57.51 32.91 22.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.54 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 57.3 t0 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.458 -179.949 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -130.41 -96.09 0.74 Allowed Glycine 0 C--N 1.33 0.196 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.02 143.7 44.9 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -89.54 24.89 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.566 0.698 . . . . 0.0 111.064 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.69 -12.05 14.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.65 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.6 mt -48.65 -23.3 0.98 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.171 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.55 -43.08 93.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.01 0.433 . . . . 0.0 110.641 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.8 mt -104.39 -40.61 6.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.647 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.36 -86.71 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 166.55 -81.02 0.0 OUTLIER 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.79 0.681 . . . . 0.0 110.96 179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.5 p-80 -113.35 163.21 15.14 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.34 0.591 . . . . 0.0 110.416 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 12.8 t -76.11 134.47 39.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.159 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -36.92 92.88 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 116.407 -0.36 . . . . 0.0 112.9 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.5 t -60.04 -42.59 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 22.2 p -110.83 -18.16 13.17 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 63.72 37.84 9.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.391 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -125.31 145.89 49.81 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.773 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -52.67 147.44 8.63 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.26 109.79 8.03 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.874 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -77.71 157.51 79.46 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.112 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.34 -33.76 94.09 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.603 1.535 . . . . 0.0 111.249 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -90.4 -2.08 57.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.375 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -23.91 65.96 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 111.655 -178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.407 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 85.9 tt0 56.12 66.95 3.12 Favored Pre-proline 0 N--CA 1.446 -0.639 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.857 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.407 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.0 Cg_exo -61.99 146.93 96.06 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.995 2.463 . . . . 0.0 111.995 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -140.44 148.15 40.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.417 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 tp -102.69 130.0 49.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.173 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -89.28 166.58 20.89 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 121.081 0.467 . . . . 0.0 111.21 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.43 -20.72 69.59 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 123.268 2.645 . . . . 0.0 112.691 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.6 p -87.42 0.78 55.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.047 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 74.67 47.48 0.12 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.892 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.6 m170 -129.6 123.98 32.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.151 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -86.64 131.47 34.14 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.257 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -144.11 162.52 36.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.485 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.09 149.12 48.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.344 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 t -60.04 -46.52 89.24 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.396 0.617 . . . . 0.0 110.199 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.99 95.58 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.785 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.6 m -70.08 -25.8 63.69 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.959 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.89 -34.36 73.44 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.542 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -52.99 -58.68 10.94 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.815 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.77 -18.63 21.91 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 123.008 2.472 . . . . 0.0 112.582 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.05 -36.68 75.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.788 0.327 . . . . 0.0 110.344 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.84 120.25 79.79 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.053 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.01 154.79 52.93 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.93 1.753 . . . . 0.0 112.804 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -90.29 44.77 1.22 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.116 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 67.3 8.31 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.999 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.53 97.72 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-O 120.84 0.353 . . . . 0.0 110.658 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -92.71 107.59 19.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.784 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 61.9 m -88.36 65.18 7.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 90.6 p -156.97 163.99 38.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.587 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 135.24 139.34 4.02 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -66.29 -41.65 89.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.816 0.341 . . . . 0.0 111.051 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -61.07 -40.64 98.8 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -152.83 160.1 28.84 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.71 -38.88 82.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.972 0.415 . . . . 0.0 110.359 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -127.92 157.96 39.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.394 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -80.35 -158.06 16.61 Favored Glycine 0 CA--C 1.519 0.293 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.4 t0 74.08 81.37 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.889 0.376 . . . . 0.0 110.572 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.0 -18.13 37.15 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 67.6 p -115.57 -118.85 0.32 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 21.3 m -60.68 132.95 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.164 0.507 . . . . 0.0 110.312 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.53 131.27 56.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.066 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -71.14 135.56 47.69 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.591 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.476 ' O ' ' N ' ' A' ' 121' ' ' LYS . 24.3 t -115.75 132.86 22.95 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.814 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -54.33 -17.83 13.04 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 CA-C-N 120.794 1.319 . . . . 0.0 112.493 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.7 t -94.38 -50.54 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.48 -31.31 11.35 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.452 0.644 . . . . 0.0 110.265 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.3 mptt 57.65 26.98 13.59 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.831 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -169.64 110.44 0.44 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.779 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -103.25 160.51 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.683 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 74.7 m -93.46 -44.42 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -145.3 167.78 22.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.534 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 51.3 p -105.16 44.45 1.03 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -88.42 -36.34 16.57 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -108.29 21.25 17.59 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 13.3 pt -70.33 -170.02 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.424 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -38.73 108.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 O-C-N 123.782 0.676 . . . . 0.0 110.39 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.1 -27.33 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 124.613 1.196 . . . . 0.0 110.772 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -84.41 74.46 10.36 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.753 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -85.67 114.02 22.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.031 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -96.79 -179.68 4.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.307 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 17.0 ptm -49.33 159.9 0.28 Allowed 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -98.36 80.24 2.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.446 -179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -80.7 106.61 12.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.553 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.1 p -170.34 156.59 5.73 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.42 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 56.85 34.44 65.21 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 49.7 m 57.44 40.7 27.09 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.149 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -105.6 140.73 38.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -150.21 141.53 23.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.571 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.51 98.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.46 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 69.4 p -135.17 162.54 32.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.584 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t0 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.523 179.868 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.642 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -160.76 -98.24 0.13 Allowed Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.18 138.34 57.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 110.317 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -92.03 21.87 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.461 0.648 . . . . 0.0 110.847 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.04 -12.42 11.69 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.815 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 35.5 mt -49.58 -23.64 1.76 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.347 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.39 -43.27 92.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 68.5 mt -104.19 -40.62 6.07 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.936 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.8 -87.87 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 165.79 -79.28 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 O-C-N 124.06 0.85 . . . . 0.0 110.969 178.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -108.26 164.43 12.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.166 0.508 . . . . 0.0 110.513 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.17 135.03 39.76 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.931 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.41 -37.8 94.2 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 121.442 -0.409 . . . . 0.0 113.011 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.8 t -62.02 -42.71 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.53 -16.05 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.03 0.443 . . . . 0.0 110.962 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.12 29.22 16.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.415 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -114.89 143.83 44.51 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.496 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.2 ttt180 -54.4 151.35 7.71 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.769 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.54 104.2 8.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.192 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -77.34 157.22 80.82 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.363 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -56.16 -38.65 94.58 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 C-N-CA 121.787 1.658 . . . . 0.0 111.064 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -86.86 -1.88 58.15 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.898 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -67.86 -24.24 65.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.982 0.42 . . . . 0.0 111.134 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.426 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 78.5 tt0 57.65 65.71 3.3 Favored Pre-proline 0 N--CA 1.445 -0.705 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.296 -178.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.5 Cg_exo -63.05 146.45 94.59 Favored 'Trans proline' 0 C--N 1.301 -1.931 0 C-N-CA 122.367 2.044 . . . . 0.0 111.221 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -140.15 148.79 42.15 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.294 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.6 tp -103.38 127.53 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.142 0.496 . . . . 0.0 111.445 -178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.4 mp -89.77 164.62 28.2 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.234 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.41 -6.73 19.8 Favored 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 123.037 2.491 . . . . 0.0 112.532 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 20.0 p -94.11 -0.87 55.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.404 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 77.46 41.52 0.14 Allowed 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 123.926 0.766 . . . . 0.0 110.969 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -134.58 119.2 18.11 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.679 178.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.5 m -87.02 140.26 29.74 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -152.41 164.1 38.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.578 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.422 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -65.34 137.59 57.62 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -56.32 -43.43 78.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.516 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.74 91.12 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 84.2 m -67.48 -33.55 75.34 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.53 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 74.7 mt -65.53 -37.33 86.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.04 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -47.57 -63.71 3.28 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.78 -27.03 69.47 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.882 2.388 . . . . 0.0 111.787 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.02 -39.67 86.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.559 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.43 122.94 85.71 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.054 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.05 143.99 81.24 Favored 'Trans proline' 0 N--CA 1.501 1.94 0 C-N-CA 122.09 1.86 . . . . 0.0 112.385 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -131.54 64.88 1.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.591 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.96 138.94 58.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.445 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.27 98.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -122.36 130.0 52.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.629 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -44.37 97.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.707 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.4 m 53.0 39.17 28.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.477 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 80.52 -172.65 54.6 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -60.98 -45.83 93.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 0.0 110.475 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -86.38 179.39 49.33 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.11 2.66 90.58 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 120.979 -0.629 . . . . 0.0 111.671 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -140.04 144.3 36.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.837 0.351 . . . . 0.0 110.481 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.54 -40.1 93.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.523 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -173.52 -103.62 0.17 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.9 t0 70.23 76.2 0.2 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.924 0.392 . . . . 0.0 110.972 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.64 -13.16 46.77 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.4 p -115.99 -120.64 0.3 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.549 -0.325 . . . . 0.0 110.451 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.0 m -64.24 151.66 9.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.058 0.456 . . . . 0.0 110.673 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.89 133.89 65.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.819 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.23 113.71 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.151 0.501 . . . . 0.0 110.025 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.96 138.31 19.77 Favored Pre-proline 0 C--O 1.213 -0.828 0 CA-C-N 115.228 -0.897 . . . . 0.0 108.832 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.66 -15.41 48.58 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 121.165 1.243 . . . . 0.0 112.58 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 52.1 t -94.46 -61.99 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.576 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -90.45 -24.85 20.6 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.433 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.7 mptt 49.75 24.25 1.2 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.839 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.13 116.37 0.84 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -118.38 156.97 28.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.615 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 6.4 t -83.46 -49.95 8.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.15 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -141.19 176.8 8.55 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.489 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.03 50.79 1.11 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.56 0.695 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -85.03 -26.84 26.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.462 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -113.62 23.72 12.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 111.43 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 15.3 pt -60.16 -172.34 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.784 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 m -41.24 104.58 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 O-C-N 123.758 0.662 . . . . 0.0 110.698 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.38 -33.52 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.405 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -82.96 68.57 9.5 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.573 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -95.67 32.73 1.77 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -61.71 -39.04 90.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.55 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.7 mmt -95.14 127.61 41.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.104 0.478 . . . . 0.0 110.9 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -136.51 45.4 2.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.754 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -62.8 145.2 55.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.7 p -179.87 -40.64 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 92.46 150.77 26.65 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m 51.53 28.14 4.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 110.504 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -61.47 -44.51 96.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.1 143.79 57.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.535 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.73 150.73 34.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.563 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 81.8 p -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.566 -179.959 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.657 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.26 -39.67 98.01 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.65 139.7 49.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.339 . . . . 0.0 110.116 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -89.27 12.39 16.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.97 -11.29 3.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.11 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.1 mt -47.39 -28.15 1.96 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.515 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -49.26 -45.98 45.61 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.67 -40.84 5.86 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.599 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.1 -83.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 123.432 0.457 . . . . 0.0 109.777 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 164.65 -76.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.091 0.869 . . . . 0.0 111.303 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 -103.06 165.2 11.16 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.386 0.612 . . . . 0.0 110.41 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 20.2 t -81.35 135.94 35.71 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.205 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.09 92.67 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 116.521 -0.308 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.37 -41.16 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 4.4 p -113.56 -16.16 12.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.923 0.392 . . . . 0.0 111.16 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 62.99 38.83 10.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.319 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -128.1 145.28 51.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.098 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -51.69 153.78 2.25 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.336 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.5 mt -82.56 102.42 11.39 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.863 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -66.56 162.17 52.73 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.151 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.31 -39.24 86.06 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 121.924 1.75 . . . . 0.0 111.05 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -90.17 0.81 56.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.512 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -66.88 -23.74 66.04 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.126 0.489 . . . . 0.0 110.784 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 50.61 74.51 0.79 Allowed Pre-proline 0 N--CA 1.45 -0.429 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -70.71 152.81 64.67 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 123.03 2.487 . . . . 0.0 112.283 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -147.14 152.43 38.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.656 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 tp -108.92 128.41 54.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.313 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -83.84 165.58 38.66 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.295 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -62.4 -16.7 53.37 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 123.126 2.551 . . . . 0.0 112.251 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.5 p -88.42 -0.9 57.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.4 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.34 49.17 0.07 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.432 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -133.99 124.02 25.59 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.605 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.4 m -86.52 140.28 30.06 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.307 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -156.08 163.83 39.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.916 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.3 m -65.14 149.87 49.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.211 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.3 t -59.99 -46.35 89.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.645 0.736 . . . . 0.0 109.796 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.23 96.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.271 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 99.4 m -69.88 -26.79 64.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 109.729 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.9 -38.25 85.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.696 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.9 -60.17 7.31 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.81 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.21 -29.29 37.15 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 123.283 2.655 . . . . 0.0 112.372 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.4 81.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.186 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.56 116.49 66.41 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.04 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -58.39 146.01 91.69 Favored 'Trans proline' 0 N--CA 1.501 1.914 0 C-N-CA 122.114 1.876 . . . . 0.0 112.421 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -142.67 -87.74 0.14 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.74 -41.38 99.16 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.841 0.353 . . . . 0.0 110.782 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.12 94.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.882 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -90.22 99.69 12.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.74 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.2 m -109.24 -52.27 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.483 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 98.7 p -112.53 -18.3 12.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.999 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 86.13 173.09 49.14 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -165.84 164.07 18.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.848 0.356 . . . . 0.0 110.82 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 72.28 18.22 77.99 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 74.12 18.08 79.66 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -149.3 153.57 37.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.827 0.346 . . . . 0.0 110.519 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -142.29 145.54 34.11 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.471 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -106.35 -152.12 19.42 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t0 71.95 79.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.892 0.377 . . . . 0.0 111.006 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.58 -16.43 40.77 Favored Glycine 0 N--CA 1.453 -0.213 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.5 p -114.91 -120.55 0.3 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.647 -0.276 . . . . 0.0 110.356 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 2.7 m -66.96 138.33 23.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.415 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.1 t -110.47 132.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.8 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 122.52 25.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.731 0.777 . . . . 0.0 109.944 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 49.7 t -108.94 135.52 20.13 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.655 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.41 -11.19 15.64 Favored 'Trans proline' 0 C--N 1.302 -1.897 0 C-N-CA 121.084 1.19 . . . . 0.0 112.679 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -93.97 -62.41 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.648 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 10.2 p -96.8 -24.73 15.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.936 0.398 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 54.73 29.54 11.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.808 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -156.48 139.03 14.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.118 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -141.64 158.42 43.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.714 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 34.6 t -94.66 -55.04 3.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.169 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -144.0 175.18 10.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.564 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 78.9 p -104.46 54.24 0.73 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.674 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -87.62 -43.03 12.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.528 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -107.8 19.23 20.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.667 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.7 pt -59.02 -172.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.624 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -39.33 112.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 O-C-N 123.827 0.704 . . . . 0.0 110.608 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 165.74 -29.62 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 124.621 1.201 . . . . 0.0 110.713 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -87.64 101.14 13.36 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.742 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 48.2 p90 -108.37 143.63 37.02 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.608 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -108.66 -81.01 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 16.8 tpt -145.09 141.24 28.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -89.27 44.55 1.22 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.742 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -81.82 146.41 29.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.686 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 52.7 p -142.52 -28.13 0.6 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 133.81 -169.34 22.89 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 99.0 p -68.06 -10.09 51.11 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.399 -0.4 . . . . 0.0 110.545 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -60.41 -29.98 69.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.176 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.2 138.4 58.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.496 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -155.27 152.39 29.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 70.8 p -70.04 -26.21 63.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.446 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 67.4 t0 . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.352 179.935 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.694 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.54 145.19 40.06 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 61.92 113.86 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.12 0.486 . . . . 0.0 110.471 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -88.93 30.72 0.91 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.442 0.639 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.92 -12.5 18.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.529 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 38.9 mt -49.23 -23.63 1.43 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.242 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -59.24 -43.21 92.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.989 0.423 . . . . 0.0 110.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.0 mt -104.3 -40.64 6.04 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.94 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.27 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 165.12 -79.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 O-C-N 123.987 0.804 . . . . 0.0 110.978 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -106.2 166.4 10.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.239 0.542 . . . . 0.0 110.688 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.6 t -79.2 135.34 36.77 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.259 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.28 -37.91 93.28 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.615 -0.326 . . . . 0.0 112.851 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.32 -41.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.0 p -110.04 -18.07 13.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.95 0.405 . . . . 0.0 111.204 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.34 39.67 9.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.53 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -128.76 144.1 51.08 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.123 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -50.7 152.6 1.97 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.366 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -81.14 112.47 18.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.977 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -82.78 158.38 65.35 Favored Pre-proline 0 N--CA 1.462 0.162 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.394 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.12 -40.24 86.15 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.063 1.842 . . . . 0.0 111.831 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -85.97 -0.32 55.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.43 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -67.51 -24.99 65.63 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 111.482 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.426 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 81.9 tt0 56.27 65.72 3.97 Favored Pre-proline 0 N--CA 1.444 -0.766 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.841 -177.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.4 Cg_exo -63.08 147.34 94.43 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.736 2.291 . . . . 0.0 111.545 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -143.69 149.54 37.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.241 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.99 123.56 48.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.119 0.485 . . . . 0.0 112.154 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 mp -77.37 165.73 49.52 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.626 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -64.84 -16.17 54.03 Favored 'Trans proline' 0 C--N 1.307 -1.61 0 C-N-CA 123.245 2.63 . . . . 0.0 112.16 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 9.9 p -91.12 1.4 57.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.101 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 75.76 49.81 0.07 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.566 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -134.14 125.43 27.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.752 178.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.8 m -85.58 142.46 29.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.084 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -156.52 163.06 39.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.673 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.4 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.6 m -69.61 135.36 49.87 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.433 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.2 t -56.23 -39.8 73.09 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.634 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.97 88.38 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.7 m -67.24 -36.84 82.49 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.624 0.725 . . . . 0.0 110.215 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 73.3 mt -64.29 -35.96 82.54 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.776 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.47 -62.92 4.06 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.726 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.97 -21.4 27.89 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.512 2.142 . . . . 0.0 112.03 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.57 75.96 0.28 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -160.48 147.79 12.41 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -54.74 -40.45 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 122.175 1.916 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 45.32 30.72 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.116 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -120.76 104.75 10.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.832 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.46 99.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.491 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -73.25 133.06 43.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.73 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.4 m -62.35 145.62 53.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.367 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.5 t -147.85 147.45 29.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.717 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.35 158.42 29.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -63.55 143.69 57.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.762 0.315 . . . . 0.0 110.622 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 70.99 -155.14 52.65 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -70.78 157.91 53.61 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.859 -0.897 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.29 150.2 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.764 0.316 . . . . 0.0 110.489 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.99 152.36 31.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.677 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 175.91 179.56 46.48 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.9 t0 63.45 70.19 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.945 0.402 . . . . 0.0 110.8 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.03 -8.51 38.89 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.6 p -116.16 -120.09 0.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 2.4 m -62.72 145.11 13.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.074 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 90.6 t -112.09 133.29 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.21 0.528 . . . . 0.0 111.63 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -74.22 106.42 5.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.829 0.824 . . . . 0.0 110.057 179.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.437 ' O ' ' HG2' ' A' ' 121' ' ' LYS . 7.6 t -104.05 126.99 30.21 Favored Pre-proline 0 C--O 1.202 -1.406 0 CA-C-N 114.756 -1.111 . . . . 0.0 108.63 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.32 -9.08 22.54 Favored 'Trans proline' 0 C--N 1.296 -2.226 0 CA-C-N 121.188 1.46 . . . . 0.0 113.171 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 40.5 t -85.82 -54.88 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.147 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.4 p -105.49 -27.79 11.2 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.118 0.485 . . . . 0.0 110.482 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 0.3 OUTLIER 62.05 35.9 15.7 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.209 178.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -166.74 141.84 4.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -150.22 158.75 44.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.638 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 79.2 m -96.04 -47.38 6.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.438 . . . . 0.0 110.089 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -142.61 176.45 9.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.355 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -120.87 46.74 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.374 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.23 -30.45 19.69 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.349 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -106.19 16.74 24.5 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 44.5 pt -70.95 -169.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.99 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -41.67 109.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 O-C-N 123.727 0.642 . . . . 0.0 110.075 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 163.92 -34.25 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 124.827 1.33 . . . . 0.0 111.072 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -59.59 -42.23 92.08 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 75.9 t80 37.9 73.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.965 0.79 . . . . 0.0 111.193 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.76 -50.3 74.36 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.99 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.3 ttt 178.03 -165.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.385 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.7 mtm180 -116.6 92.81 3.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.807 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.93 -36.62 79.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -43.36 130.02 4.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.922 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -84.55 57.93 5.01 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 57.1 m 52.05 37.9 22.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.769 0.319 . . . . 0.0 110.679 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -72.0 132.18 43.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.778 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -150.23 150.24 31.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.592 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -154.08 150.58 28.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.718 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 71.0 p -89.44 -14.34 35.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.974 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.0 t0 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.221 -179.937 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.582 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 83.06 0.99 90.59 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 60.79 109.12 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.001 0.429 . . . . 0.0 110.449 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -86.74 26.59 1.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.49 0.662 . . . . 0.0 110.709 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.15 -12.1 11.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.584 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 46.3 mt -47.48 -23.8 0.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.989 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -59.66 -43.09 94.07 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.643 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.0 mt -103.96 -40.95 6.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.366 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.46 -88.28 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 164.6 -81.17 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.85 0.718 . . . . 0.0 110.891 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -102.22 168.91 9.05 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.095 0.474 . . . . 0.0 110.134 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 12.4 t -84.34 138.43 32.89 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.032 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.28 -36.41 89.55 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.584 -0.341 . . . . 0.0 113.075 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.7 t -59.61 -43.16 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.7 p -109.0 -20.53 13.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.968 0.414 . . . . 0.0 111.305 -178.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 65.62 34.26 7.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.421 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -126.42 145.69 50.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.119 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 9.6 ttm-85 -49.71 149.75 2.37 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.531 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.18 115.58 14.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.772 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -80.75 162.08 61.53 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.507 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.27 -38.08 46.41 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 121.791 1.66 . . . . 0.0 111.585 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.65 0.61 57.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.821 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -24.28 66.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.91 0.386 . . . . 0.0 111.522 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 55.92 69.0 2.04 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-O 121.289 0.566 . . . . 0.0 110.206 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.54 151.68 70.36 Favored 'Trans proline' 0 C--N 1.299 -2.027 0 C-N-CA 123.442 2.762 . . . . 0.0 111.963 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -144.87 167.01 23.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.821 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.38 126.26 51.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.9 mp -86.63 164.68 36.39 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.278 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.46 -6.0 18.06 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.926 2.417 . . . . 0.0 112.063 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -94.33 2.34 55.83 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.333 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 76.42 39.15 0.27 Allowed 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.513 0.673 . . . . 0.0 111.222 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -134.5 120.29 19.52 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.944 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.9 m -86.56 142.83 28.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.13 167.41 29.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.882 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -71.32 136.13 47.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.6 t -53.04 -42.96 66.25 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.92 91.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.2 m -68.44 -33.58 74.45 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.659 0.742 . . . . 0.0 110.495 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 70.4 mt -63.97 -36.37 83.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.162 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.77 -65.27 2.94 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.97 -29.73 74.8 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.016 2.477 . . . . 0.0 111.551 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.69 -38.17 77.67 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.463 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.68 123.24 71.11 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.461 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -53.82 143.6 58.68 Favored 'Trans proline' 0 N--CA 1.498 1.758 0 C-N-CA 122.006 1.804 . . . . 0.0 112.192 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -109.01 41.51 1.6 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.44 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 64.99 11.49 7.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.7 94.19 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 120.929 0.395 . . . . 0.0 110.632 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -156.58 -178.93 7.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.696 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.3 t -111.41 136.06 51.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.532 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.6 m -60.97 -41.03 95.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.549 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 178.2 172.24 42.41 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -67.08 139.67 57.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.683 0.278 . . . . 0.0 110.423 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 71.66 -170.4 48.83 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 56.48 -131.51 51.05 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -124.82 124.46 42.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.857 0.36 . . . . 0.0 110.594 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.37 92.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.419 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 122.8 -176.91 16.59 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.7 t0 67.89 83.84 0.16 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 110.924 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.42 -18.26 35.81 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.7 p -115.22 -120.71 0.3 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.656 -0.272 . . . . 0.0 110.318 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.0 m -63.17 142.94 16.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.936 0.398 . . . . 0.0 110.203 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 96.7 t -113.48 139.95 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.253 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.4 116.17 21.75 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.395 0.617 . . . . 0.0 109.894 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 48.9 t -106.04 133.99 19.96 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.196 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.73 -11.35 11.54 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.272 1.315 . . . . 0.0 113.302 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 15.0 t -94.59 -62.14 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.475 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.7 p -97.14 -26.55 14.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.017 0.436 . . . . 0.0 110.568 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.6 mptt 56.25 27.51 11.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.707 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -160.37 136.24 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.947 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -141.6 161.81 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.67 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 11.7 p -95.28 -43.81 7.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.363 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -143.26 177.08 8.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.896 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.99 53.53 1.07 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 111.58 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -88.65 -30.34 19.25 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.699 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -112.62 23.06 13.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.615 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 18.0 pt -70.15 -172.95 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 120.882 0.372 . . . . 0.0 111.35 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -45.25 106.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.574 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 163.87 -40.1 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 124.973 1.421 . . . . 0.0 111.106 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -89.99 72.88 7.41 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.691 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 p90 -68.14 143.56 55.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.108 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -78.38 0.57 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.395 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.0 mmm -129.42 147.11 51.21 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.616 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.6 mtm-85 -110.31 42.17 1.61 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.454 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -73.15 153.14 40.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.641 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.2 p -175.99 -69.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.878 -179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -157.11 -109.25 0.29 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 6.2 t -85.37 61.77 7.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 0.0 110.43 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -58.51 -38.4 77.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.695 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.46 -36.44 75.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.72 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -66.08 145.59 55.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.577 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 74.2 p -68.25 -29.14 67.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.527 179.877 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.724 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.69 158.21 53.43 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 58.63 94.31 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.884 0.373 . . . . 0.0 110.694 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -86.38 42.54 1.0 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.653 0.739 . . . . 0.0 110.73 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.85 -13.3 23.09 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.999 -1.0 . . . . 0.0 111.366 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.3 mt -47.31 -24.58 0.79 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.411 0.444 . . . . 0.0 110.969 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -60.28 -44.35 95.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.989 0.423 . . . . 0.0 110.806 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.1 mt -103.58 -42.63 5.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.658 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.07 -90.63 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 166.22 -80.13 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.703 0.801 . . . . 0.0 111.298 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -107.59 165.42 11.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.359 0.6 . . . . 0.0 110.346 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 40.9 t -79.62 147.76 31.93 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.606 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -35.98 40.35 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.187 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 68.1 t -62.57 -37.6 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.932 0.396 . . . . 0.0 111.498 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 -26.19 10.76 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.383 -178.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 66.51 24.66 10.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.791 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -122.26 150.3 42.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.236 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -50.91 150.17 3.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.28 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.8 mt -80.59 118.41 22.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.347 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.28 165.72 16.25 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.022 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -52.56 -51.19 11.69 Favored 'Trans proline' 0 C--N 1.303 -1.862 0 C-N-CA 122.164 1.909 . . . . 0.0 112.96 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -72.14 -7.42 49.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.079 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.28 -24.34 64.86 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 121.106 -0.238 . . . . 0.0 110.919 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 49.03 71.64 1.53 Allowed Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 121.075 0.465 . . . . 0.0 110.086 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.58 148.13 82.96 Favored 'Trans proline' 0 C--N 1.295 -2.244 0 C-N-CA 122.819 2.346 . . . . 0.0 112.15 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.39 144.77 32.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.925 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.46 126.09 46.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.094 0.473 . . . . 0.0 111.104 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 mp -87.95 164.15 34.96 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.988 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -70.59 -6.77 19.78 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 C-N-CA 122.784 2.323 . . . . 0.0 112.025 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.8 p -94.56 2.52 55.66 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.509 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 74.45 41.59 0.35 Allowed 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.96 0.787 . . . . 0.0 111.074 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -134.62 118.15 16.89 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.031 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.46 135.55 33.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.242 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -149.89 167.46 26.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.512 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.3 m -71.6 135.49 46.99 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.955 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.4 t -51.63 -44.08 62.82 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.491 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.06 92.78 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.589 -0.445 . . . . 0.0 109.946 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 89.6 m -68.29 -33.53 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.698 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.14 -35.43 81.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.486 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -44.29 -64.98 1.82 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.12 -20.74 71.85 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.633 2.222 . . . . 0.0 112.137 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.99 -38.29 85.49 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.032 0.444 . . . . 0.0 109.899 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.88 122.31 84.47 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.368 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.02 141.72 56.06 Favored 'Trans proline' 0 N--CA 1.502 1.987 0 C-N-CA 122.423 2.082 . . . . 0.0 112.41 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -143.07 -80.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 178.3 32.3 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.491 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.43 -41.29 96.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.663 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -126.32 -30.07 2.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.662 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 80.7 p -71.32 157.22 38.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.583 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.0 t -62.79 -43.78 97.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.625 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 138.84 -138.64 9.56 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 55.69 43.71 27.58 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.836 0.35 . . . . 0.0 110.628 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -78.68 179.73 52.13 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.32 -56.47 0.56 Allowed Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.25 94.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.353 . . . . 0.0 110.408 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -144.16 101.64 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.563 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 90.36 169.69 43.28 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.6 t0 64.5 77.23 0.32 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.737 0.303 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.55 -15.9 45.15 Favored Glycine 0 N--CA 1.452 -0.281 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 -179.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 80.9 p -115.58 -121.14 0.3 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.666 -0.267 . . . . 0.0 110.998 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.1 m -61.8 143.67 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 120.871 0.367 . . . . 0.0 110.052 -179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 69.5 t -110.99 137.32 43.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.479 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.72 113.44 19.7 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.608 0.718 . . . . 0.0 111.035 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 121' ' ' LYS . 42.7 t -104.11 133.78 20.05 Favored Pre-proline 0 C--N 1.312 -1.042 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.464 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.29 -10.45 8.51 Favored 'Trans proline' 0 C--N 1.301 -1.961 0 C-N-CA 121.682 1.588 . . . . 0.0 113.433 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 38.9 t -94.81 -61.82 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.939 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 13.0 p -98.12 -29.5 13.2 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 110.95 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.0 mptt 58.01 28.99 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -161.42 137.29 7.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.717 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -143.85 154.38 43.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.732 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 5.6 t -83.76 -50.05 8.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -139.25 176.98 8.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.869 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.99 45.23 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.735 0.778 . . . . 0.0 111.599 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -86.53 -19.58 29.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.414 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.59 22.63 13.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.999 0.428 . . . . 0.0 110.908 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 25.2 pt -63.71 -170.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.5 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -40.69 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 O-C-N 123.895 0.747 . . . . 0.0 110.66 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 175.38 -31.74 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 124.186 0.929 . . . . 0.0 110.79 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -84.96 71.05 10.97 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.126 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -92.66 31.14 1.4 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.938 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.38 -37.26 80.19 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.425 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 36.5 tpp -82.55 109.33 16.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.799 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.1 mtm180 -152.78 82.97 1.22 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.802 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -119.97 11.39 11.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.019 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 15.5 m -62.47 141.07 58.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.739 0.304 . . . . 0.0 110.241 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 177.52 -165.94 36.02 Favored Glycine 0 CA--C 1.522 0.49 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 51.2 m 57.91 26.0 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.647 0.261 . . . . 0.0 110.336 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -128.65 131.19 48.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.32 150.98 31.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.799 0.333 . . . . 0.0 110.707 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -152.87 155.08 36.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.607 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 80.8 p -74.5 162.67 28.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.537 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 . . . . . 0 C--O 1.219 -0.519 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.575 -179.89 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.658 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.69 149.68 46.92 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 52.28 95.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.105 0.478 . . . . 0.0 110.835 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -88.22 30.66 0.85 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.432 0.634 . . . . 0.0 110.669 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.12 -12.47 12.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.51 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.5 mt -48.5 -23.76 1.08 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.334 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.05 -42.65 90.77 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.475 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.9 mt -104.17 -39.98 6.32 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.785 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.2 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 164.94 -79.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 O-C-N 124.114 0.884 . . . . 0.0 111.045 178.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -108.03 166.92 10.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.263 0.554 . . . . 0.0 110.468 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 10.0 t -77.37 135.66 38.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.309 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.26 -38.22 94.87 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.492 -0.385 . . . . 0.0 112.779 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 72.4 t -61.41 -42.54 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.14 -16.33 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 111.074 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.28 28.8 15.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.548 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -115.6 145.28 42.83 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.915 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -52.71 149.24 6.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.447 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.71 103.19 5.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.812 -178.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -71.38 157.72 89.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.385 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -37.14 95.65 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 121.616 1.544 . . . . 0.0 110.785 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.18 0.7 55.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.209 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -67.33 -24.76 65.77 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 111.332 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.431 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 87.6 tt0 53.72 66.28 4.67 Favored Pre-proline 0 N--CA 1.438 -1.042 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.418 -177.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.9 Cg_exo -62.0 146.2 96.38 Favored 'Trans proline' 0 C--N 1.302 -1.887 0 C-N-CA 122.458 2.105 . . . . 0.0 111.906 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -138.82 142.67 38.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.541 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.6 tp -99.82 126.55 45.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.307 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 mp -83.45 165.59 39.46 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.884 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -64.74 -14.42 44.7 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 123.205 2.604 . . . . 0.0 112.502 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -92.15 1.04 57.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.15 46.72 0.09 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.04 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -131.11 119.32 21.77 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.487 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -87.1 132.53 33.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.995 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -147.25 162.37 39.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.4 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.7 m -59.52 147.56 36.41 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.27 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -60.42 -44.28 95.91 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.344 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.47 -40.63 97.28 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.901 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.9 m -67.64 -34.12 76.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.064 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.86 -36.99 85.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.155 -179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.61 -59.99 7.34 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.327 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -64.0 -16.42 54.8 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.43 2.087 . . . . 0.0 112.139 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.34 -37.58 81.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.008 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.36 126.26 72.15 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.606 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.32 144.06 92.16 Favored 'Trans proline' 0 N--CA 1.501 1.961 0 C-N-CA 122.006 1.804 . . . . 0.0 112.414 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -147.98 139.15 23.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.718 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -159.14 140.07 12.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.582 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.08 -40.93 99.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -143.92 109.95 5.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 31.7 t -85.34 125.99 33.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.561 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 96.3 p -63.34 -26.8 68.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.474 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 62.48 -147.09 49.72 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 52.5 t0 51.57 44.2 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.726 0.298 . . . . 0.0 110.618 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 175.33 -179.24 46.69 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -121.23 -156.84 9.9 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.39 39.93 6.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.874 0.369 . . . . 0.0 110.737 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.45 148.29 29.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.604 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -115.06 -115.19 3.02 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.172 -1.171 . . . . 0.0 110.172 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.5 t0 75.47 81.34 0.1 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.051 0.453 . . . . 0.0 111.459 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.75 -17.34 45.97 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.26 -123.18 0.29 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.1 m -62.05 148.08 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-O 121.416 0.627 . . . . 0.0 110.715 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 88.3 t -107.57 141.52 22.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.205 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.34 135.08 34.04 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.971 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 42.0 t -122.82 134.25 24.92 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.369 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -64.91 -9.16 20.26 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 CA-C-N 120.431 1.19 . . . . 0.0 112.556 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 17.3 t -93.26 -61.27 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.326 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 29.1 p -99.51 -22.28 15.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.4 mptt 55.07 29.25 12.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.157 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -162.03 129.92 4.05 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.988 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.72 130.59 53.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.895 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 93.4 m -61.69 -47.7 84.1 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.772 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -145.2 176.8 9.26 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.465 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.3 32.18 5.17 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.017 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -86.2 -31.17 21.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.628 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -103.86 22.49 14.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.884 0.373 . . . . 0.0 111.668 -179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 41.3 pt -68.19 -169.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.775 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 131' ' ' GLU . 2.2 m -36.49 104.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 O-C-N 124.045 0.84 . . . . 0.0 110.828 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 130' ' ' VAL . 5.5 mt-10 170.79 -32.75 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 124.027 0.829 . . . . 0.0 110.362 -178.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -83.45 64.36 7.81 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.795 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -97.81 29.25 3.47 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.414 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.4 -48.01 83.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.628 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.7 tpt -77.31 119.83 21.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.23 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.8 mtm180 -123.8 35.82 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.035 0.445 . . . . 0.0 110.806 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.47 141.89 58.18 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.757 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.9 p -174.65 -30.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.132 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 178.14 -151.31 10.52 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 96.4 p -62.28 -20.39 64.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.01 0.434 . . . . 0.0 110.575 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.21 136.44 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.253 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 52.81 21.63 2.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.953 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -71.56 144.42 49.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.784 0.326 . . . . 0.0 110.796 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -74.51 -30.14 61.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.518 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.7 t0 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.42 -179.977 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.623 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 74.3 25.05 71.7 Favored Glycine 0 CA--C 1.52 0.402 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 62.31 112.94 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.093 0.473 . . . . 0.0 110.387 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 49.7 mp0 -84.0 32.42 0.48 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.475 0.655 . . . . 0.0 110.823 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -11.65 13.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.405 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.5 mt -48.36 -22.36 0.68 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.612 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -58.44 -42.37 87.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.068 0.461 . . . . 0.0 110.206 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.5 mt -104.31 -39.59 6.42 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.72 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.26 -84.1 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 166.52 -80.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.978 0.799 . . . . 0.0 110.966 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.99 170.14 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.104 0.478 . . . . 0.0 110.157 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 23.8 t -87.59 141.87 28.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.335 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.29 -39.21 92.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.653 -0.308 . . . . 0.0 112.38 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 74.9 t -61.52 -37.91 78.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -24.67 10.89 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.177 0.513 . . . . 0.0 111.116 -178.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 65.43 33.0 9.17 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.836 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -128.81 149.08 50.89 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.78 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -52.6 147.94 7.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.904 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.6 mt -72.78 116.51 13.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.001 -178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.95 161.8 72.32 Favored Pre-proline 0 N--CA 1.463 0.224 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.305 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.67 -40.26 74.95 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.083 1.856 . . . . 0.0 111.641 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -90.03 1.92 55.78 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.296 179.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.29 -24.83 66.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.669 -178.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 52.48 70.56 1.82 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-O 121.351 0.596 . . . . 0.0 109.899 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.11 153.57 67.18 Favored 'Trans proline' 0 C--N 1.294 -2.32 0 C-N-CA 122.843 2.362 . . . . 0.0 111.412 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.6 174.62 11.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.506 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -126.06 141.07 52.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.986 0.422 . . . . 0.0 111.33 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 mp -101.17 165.6 13.88 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-O 121.136 0.493 . . . . 0.0 110.897 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.51 -16.45 54.69 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.318 2.679 . . . . 0.0 112.155 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 26.7 p -86.31 -6.09 59.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.317 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 78.14 48.01 0.05 OUTLIER 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.923 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -129.98 121.74 27.13 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.295 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.4 m -87.06 138.64 31.32 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.998 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -157.92 166.69 31.98 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.127 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.7 m -68.83 139.68 55.22 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 t -56.75 -42.84 80.02 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.298 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.38 -40.41 94.22 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 97.8 m -71.01 -22.14 62.2 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.235 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 84.3 mt -81.17 -20.72 40.63 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.525 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -59.84 -53.42 46.07 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 120.556 -0.831 . . . . 0.0 111.571 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.24 -19.31 33.85 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.641 2.227 . . . . 0.0 111.779 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.99 -38.19 78.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -94.13 147.56 33.61 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.992 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.16 -20.69 55.85 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.559 2.172 . . . . 0.0 112.562 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.18 -38.81 80.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 146.22 47.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.428 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.43 88.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.709 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -82.83 82.18 8.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.923 0.392 . . . . 0.0 110.333 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.6 p -155.92 166.08 34.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.52 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 91.2 p -132.63 155.1 49.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.456 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.98 99.45 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 53.0 t0 51.71 46.14 27.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.504 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 76.62 -164.38 53.22 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -97.84 117.43 5.81 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -156.69 153.12 27.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.737 0.303 . . . . 0.0 110.628 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.63 142.5 58.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.699 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 167.23 -175.42 42.36 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.9 t0 69.22 76.75 0.23 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.08 -17.68 37.54 Favored Glycine 0 N--CA 1.452 -0.236 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 82.2 p -115.11 -120.92 0.3 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.568 -0.316 . . . . 0.0 110.17 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.29 142.83 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 121.017 0.437 . . . . 0.0 110.311 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.3 t -107.17 129.84 60.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.717 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -74.29 123.76 25.17 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.964 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.478 ' O ' ' N ' ' A' ' 121' ' ' LYS . 23.4 t -106.76 129.65 24.09 Favored Pre-proline 0 C--O 1.199 -1.57 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.874 -179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -61.36 -10.22 15.28 Favored 'Trans proline' 0 C--N 1.295 -2.273 0 CA-C-N 121.715 1.648 . . . . 0.0 113.34 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.7 t -85.81 -43.73 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.394 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -120.21 -30.07 4.71 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.503 0.668 . . . . 0.0 110.307 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.9 OUTLIER 65.14 35.16 8.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.146 178.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -164.3 123.12 1.87 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.32 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.13 159.64 23.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.344 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.2 m -87.59 -55.85 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.58 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -143.52 176.82 8.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 16.0 p -101.82 27.2 6.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.022 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -88.52 -28.83 20.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.382 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -112.72 22.68 14.27 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.654 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.1 pt -86.04 -169.95 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.966 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.2 m -43.27 106.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 O-C-N 123.721 0.638 . . . . 0.0 110.248 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.64 -22.41 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 124.408 1.067 . . . . 0.0 110.864 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -97.56 22.62 8.69 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.983 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -41.2 139.29 1.0 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.416 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -161.52 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.088 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.08 144.02 50.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.947 0.403 . . . . 0.0 110.059 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -82.66 68.45 9.13 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.458 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.58 134.27 54.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.922 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 12.6 p 177.48 145.42 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.624 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 53.81 -129.41 41.73 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 95.9 p -93.69 -1.21 55.5 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.925 -0.637 . . . . 0.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -83.54 127.36 33.67 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.824 0.345 . . . . 0.0 110.65 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -155.43 139.95 16.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.292 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.31 96.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.57 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 65.6 p -78.68 163.98 24.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.522 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.2 t0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 118.11 -0.947 . . . . 0.0 110.573 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.98 -96.61 0.12 Allowed Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.78 119.01 6.86 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -95.26 20.5 9.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.397 0.618 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.0 -12.32 18.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.63 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.6 mt -49.01 -23.67 1.24 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.165 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -59.68 -43.5 93.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.691 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.5 mt -104.47 -41.56 5.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.599 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.74 -89.93 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 165.24 -79.03 0.0 OUTLIER 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.5 0.72 . . . . 0.0 110.836 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -99.87 167.22 10.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.117 0.484 . . . . 0.0 110.116 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 27.2 t -82.05 136.72 35.19 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.516 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -71.46 -30.07 67.26 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.72 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.1 t -61.53 -39.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.23 -17.39 11.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 0.0 111.22 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.75 38.43 9.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.791 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -129.3 144.9 51.4 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.043 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -50.71 148.89 3.64 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.426 -179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.0 mt -75.47 120.24 20.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.466 -178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -82.76 163.03 53.4 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.204 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.08 -34.09 47.93 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 121.908 1.738 . . . . 0.0 111.579 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -92.68 -2.03 56.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.389 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -66.89 -23.88 66.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.233 0.54 . . . . 0.0 111.514 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 54.72 70.34 1.7 Allowed Pre-proline 0 N--CA 1.446 -0.636 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.877 -178.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.49 149.26 80.04 Favored 'Trans proline' 0 C--N 1.3 -1.986 0 C-N-CA 123.148 2.565 . . . . 0.0 111.913 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -141.7 162.29 35.85 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.131 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.6 tp -115.44 127.69 55.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.903 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.75 164.55 36.62 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.842 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 -6.42 19.04 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.92 2.413 . . . . 0.0 112.334 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.6 p -95.38 3.95 53.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 75.22 41.21 0.3 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.521 0.677 . . . . 0.0 111.346 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -134.55 119.75 18.82 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.732 178.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.9 m -86.64 139.63 30.61 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.911 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -149.95 166.86 28.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -68.2 151.84 46.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.697 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.4 t -60.35 -47.15 87.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.337 0.589 . . . . 0.0 110.22 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.34 -40.02 96.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.135 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.81 -27.1 64.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.998 0.427 . . . . 0.0 109.85 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.34 -37.87 80.94 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.824 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.12 -61.31 5.47 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.21 -29.51 76.02 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.961 2.441 . . . . 0.0 111.682 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.45 -40.5 91.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.172 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -87.67 117.99 69.21 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.143 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.52 137.66 73.2 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 121.941 1.761 . . . . 0.0 112.21 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.93 -27.18 14.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.576 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -159.07 156.92 30.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.05 82.77 3.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.637 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -62.62 -42.22 99.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.5 m -71.13 148.68 47.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.4 t -133.77 128.2 34.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.446 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.92 4.37 89.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -102.81 149.56 24.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.328 . . . . 0.0 110.645 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.97 152.37 51.0 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.67 18.2 79.2 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.09 -38.89 87.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.751 0.31 . . . . 0.0 110.6 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -58.19 138.85 55.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.487 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 177.93 173.95 43.82 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.1 t0 68.24 82.53 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.534 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.93 -14.69 40.9 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.74 -121.44 0.3 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.341 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.2 m -62.78 143.54 15.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 122.078 -0.389 . . . . 0.0 110.482 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 98.7 t -119.34 131.06 73.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.985 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.89 141.76 53.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.204 179.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 19.2 t -139.94 132.77 15.04 Favored Pre-proline 0 N--CA 1.444 -0.733 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.484 -179.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.06 -9.59 17.58 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 121.384 1.389 . . . . 0.0 112.798 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 6.5 t -94.56 -61.04 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.4 -179.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 11.0 p -99.05 -27.13 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.782 0.325 . . . . 0.0 110.983 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.5 31.7 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -168.25 136.69 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -142.3 123.53 14.68 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.52 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 91.8 m -61.79 -44.33 97.09 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -144.12 177.18 8.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.635 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.0 63.75 0.87 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.273 0.558 . . . . 0.0 111.582 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -89.14 -30.0 18.93 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.507 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.2 23.14 13.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 111.535 -178.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 10.6 pt -64.69 -169.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.35 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -35.59 104.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 O-C-N 123.924 0.765 . . . . 0.0 110.578 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 172.54 -34.2 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 124.135 0.897 . . . . 0.0 110.599 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -83.99 70.18 10.42 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.808 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -97.39 33.0 2.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.843 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -58.65 -48.24 81.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.9 mmt -70.1 143.68 52.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.73 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -160.43 31.06 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.39 0.614 . . . . 0.0 110.501 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -98.0 162.06 13.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 90.9 p -161.35 170.67 19.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 -179.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -60.18 -39.59 96.12 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 8.7 m -90.97 -158.3 0.55 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.6 tttt 65.53 108.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.618 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.23 36.85 28.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.405 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.89 150.03 33.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.571 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 93.7 m -71.13 130.9 42.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.789 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 93.92 112.74 2.34 Favored Glycine 0 N--CA 1.46 0.233 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -156.65 154.04 29.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.977 0.418 . . . . 0.0 110.308 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -90.12 31.16 1.01 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.827 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.03 -12.34 25.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.443 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 38.6 mt -49.41 -23.16 1.38 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.989 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -59.24 -44.43 92.35 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.835 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.9 -41.78 5.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -162.81 -87.55 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 168.36 -80.06 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.765 0.666 . . . . 0.0 111.269 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -113.79 164.05 14.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.163 0.506 . . . . 0.0 110.149 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 13.6 t -79.41 138.58 37.68 Favored 'General case' 0 C--O 1.211 -0.929 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.851 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.67 -35.82 81.45 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.741 -0.266 . . . . 0.0 112.747 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.2 t -59.09 -43.8 90.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 9.9 p -109.5 -18.43 13.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.837 0.351 . . . . 0.0 111.587 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 64.93 30.19 12.05 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.933 178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -119.7 148.58 43.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.282 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -54.27 150.83 8.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.626 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 57.7 mt -80.48 105.54 11.81 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.696 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -80.83 167.13 34.68 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.165 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -52.29 -46.83 30.29 Favored 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 122.607 2.204 . . . . 0.0 113.033 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -82.8 0.07 45.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.204 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.21 -24.46 64.94 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 47.14 73.09 1.06 Allowed Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.283 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -68.36 147.9 72.69 Favored 'Trans proline' 0 C--N 1.299 -2.063 0 C-N-CA 122.711 2.274 . . . . 0.0 112.008 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.85 156.08 45.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.792 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.4 tp -106.88 127.33 53.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.27 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 mp -86.39 167.06 24.8 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.023 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.69 -20.32 64.86 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.984 2.456 . . . . 0.0 112.224 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 7.2 p -89.64 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.63 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 73.02 50.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.994 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 51.9 m170 -128.97 124.4 34.92 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.868 178.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -85.79 132.89 34.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -151.16 165.54 33.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.043 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -71.11 136.75 48.36 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.822 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.8 t -53.95 -43.29 69.74 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.031 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.28 -39.16 89.39 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.3 m -68.09 -33.65 74.93 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.241 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 84.9 mt -67.19 -28.76 68.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.178 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.57 -60.51 8.16 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.392 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.56 -10.34 24.02 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.633 2.222 . . . . 0.0 112.624 179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.51 -30.17 66.85 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.789 0.328 . . . . 0.0 110.219 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -117.3 148.73 43.22 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.449 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -76.09 152.16 35.53 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.517 2.145 . . . . 0.0 112.466 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -156.11 146.13 21.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.482 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 48.16 42.85 18.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.612 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -117.38 -165.45 1.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.637 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -59.85 -39.36 84.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.479 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.9 t -60.67 139.59 57.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.1 t -144.19 143.53 31.12 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.336 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -61.26 -43.37 99.47 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.68 -41.97 99.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.983 0.421 . . . . 0.0 110.449 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.07 -38.22 96.22 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.68 14.81 39.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 110.674 -0.971 . . . . 0.0 110.674 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -67.92 142.74 55.94 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-O 120.833 0.349 . . . . 0.0 110.763 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.22 148.58 48.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 91.26 168.61 41.68 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.1 t0 61.16 76.69 0.36 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.831 0.348 . . . . 0.0 110.915 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.77 -17.52 35.76 Favored Glycine 0 CA--C 1.519 0.298 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 77.3 p -115.83 -120.6 0.3 Allowed 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 78.4 t -65.0 137.2 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 CA-C-O 120.964 0.411 . . . . 0.0 110.525 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 96.8 t -106.48 142.41 19.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.408 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -84.87 114.73 22.32 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.478 0.656 . . . . 0.0 111.009 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.4 t -104.56 132.97 20.44 Favored Pre-proline 0 C--O 1.206 -1.229 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.216 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.11 -16.3 26.72 Favored 'Trans proline' 0 C--N 1.297 -2.15 0 C-N-CA 121.216 1.278 . . . . 0.0 112.626 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 16.4 t -96.39 -51.72 10.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.35 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -31.7 11.67 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.953 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 117' ' ' CYS . 3.0 mptt 59.46 22.82 11.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.12 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -172.8 97.86 0.13 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.233 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -89.52 145.81 25.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 0.0 110.374 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 88.5 m -61.03 -46.52 90.41 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.498 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -145.93 178.0 8.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.918 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 1.2 p -116.28 36.85 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.48 0.657 . . . . 0.0 111.64 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -89.65 -31.22 17.62 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.623 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -108.86 20.75 18.1 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.656 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 24.2 pt -71.25 -169.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.524 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -37.68 108.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 O-C-N 123.8 0.688 . . . . 0.0 110.12 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 164.74 -31.57 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 124.818 1.324 . . . . 0.0 111.321 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -93.47 85.87 5.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.958 -0.697 . . . . 0.0 111.29 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -93.19 137.38 32.57 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.909 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -94.85 -75.78 0.51 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.815 0.34 . . . . 0.0 110.51 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 28.1 ttt -146.02 142.54 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -83.93 64.98 8.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.355 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.64 122.34 13.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.173 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 170.42 -66.66 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.792 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -60.17 -39.5 95.97 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 36.1 t -57.81 -25.69 60.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.029 0.442 . . . . 0.0 110.435 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -58.7 -41.18 85.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.241 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -126.63 39.65 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.923 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.93 -39.19 88.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.46 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.8 m -60.9 -44.39 97.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 37.1 t0 . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.677 179.758 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -107.15 -118.07 4.3 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.89 141.82 56.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.78 0.324 . . . . 0.0 110.602 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -90.8 28.81 1.45 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.724 0.774 . . . . 0.0 110.681 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.55 -11.99 19.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.5 mt -48.58 -23.59 1.05 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.277 179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.97 -43.35 91.32 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.0 110.594 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 69.9 mt -104.6 -41.06 5.8 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.022 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.23 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 165.45 -78.13 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.117 0 O-C-N 123.953 0.783 . . . . 0.0 110.75 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.5 p-80 -107.88 165.98 11.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 110.824 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 13.3 t -81.12 137.14 35.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.563 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.81 -37.98 93.92 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.676 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.1 t -59.93 -40.81 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 8.4 p -112.64 -18.63 12.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.943 0.401 . . . . 0.0 111.109 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.32 39.62 9.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.309 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.49 146.79 50.71 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.216 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -55.99 144.42 28.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.633 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.19 105.85 3.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.447 -179.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -79.93 165.8 44.84 Favored Pre-proline 0 C--N 1.333 -0.133 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.554 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -53.05 -43.53 56.24 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 122.432 2.088 . . . . 0.0 113.31 -177.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -88.15 2.26 52.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -66.01 -24.98 66.87 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.983 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 50.56 69.0 2.87 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 109.791 -179.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -68.9 150.81 73.72 Favored 'Trans proline' 0 C--N 1.293 -2.386 0 C-N-CA 122.628 2.219 . . . . 0.0 111.078 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.32 165.49 29.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.673 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp -114.35 130.19 56.67 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.914 0.388 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mp -90.16 164.54 27.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.242 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.51 -6.2 18.6 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.043 2.495 . . . . 0.0 112.33 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.77 0.91 55.33 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.376 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 77.65 41.54 0.13 Allowed 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 123.825 0.703 . . . . 0.0 111.338 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -135.29 119.85 18.14 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.995 178.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -86.52 141.64 28.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.9 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -157.63 166.86 31.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . 0.452 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -65.77 137.05 56.99 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.9 t -56.72 -42.19 78.76 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.069 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.27 91.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 80.8 m -66.83 -36.25 81.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.204 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 88' ' ' CYS . 82.0 mt -66.09 -30.55 71.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.27 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.95 -62.35 4.65 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.866 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.38 -17.29 59.37 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.131 1.887 . . . . 0.0 112.05 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.01 -37.28 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.328 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.16 122.31 85.13 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.152 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.17 141.71 79.59 Favored 'Trans proline' 0 N--CA 1.5 1.862 0 C-N-CA 121.969 1.78 . . . . 0.0 112.189 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -148.03 -64.54 0.26 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.663 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.9 92.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.63 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -118.61 149.33 41.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.334 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.34 -39.8 91.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.6 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.1 t 64.59 117.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.593 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 70.8 m -64.16 145.05 56.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.74 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -176.87 172.95 45.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -77.09 -1.57 29.78 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.34 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -91.9 61.96 2.63 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.476 -1.049 . . . . 0.0 110.476 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.0 24.98 76.16 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.09 23.67 14.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.302 . . . . 0.0 110.543 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 147.56 23.02 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.878 0.37 . . . . 0.0 110.538 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -116.04 -146.76 8.76 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.6 t0 73.03 81.65 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.783 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.31 -17.4 40.48 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 75.6 p -115.7 -122.16 0.29 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.9 m -63.3 142.91 16.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.807 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 56.4 t -113.63 140.72 32.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.421 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -87.74 129.25 35.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.537 0.684 . . . . 0.0 109.913 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.482 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.0 t -116.12 131.41 23.78 Favored Pre-proline 0 C--O 1.195 -1.765 0 CA-C-N 114.805 -1.088 . . . . 0.0 108.226 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -59.6 -11.5 14.44 Favored 'Trans proline' 0 C--N 1.295 -2.25 0 CA-C-N 121.502 1.572 . . . . 0.0 113.176 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.4 t -84.01 -44.82 18.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.541 -0.463 . . . . 0.0 111.7 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.55 -30.69 5.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.02 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.2 OUTLIER 64.24 31.44 13.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.073 178.581 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -162.72 139.43 7.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.996 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -143.05 161.49 38.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.077 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 80.4 m -96.48 -43.16 7.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.998 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -142.34 175.05 10.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.251 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -125.06 42.71 3.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.336 0.588 . . . . 0.0 111.217 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -85.75 -15.45 42.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.031 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -114.33 22.48 13.69 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.6 pt -69.12 -173.65 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.774 0.321 . . . . 0.0 111.144 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.3 m -45.47 105.61 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.284 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.572 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 168.26 -32.16 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 124.152 0.908 . . . . 0.0 110.576 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -93.31 64.95 3.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.154 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -60.83 139.37 57.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.394 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -93.56 -72.95 0.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.485 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.7 ttt -150.79 144.86 25.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.596 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -122.48 99.69 6.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -135.75 34.6 2.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.696 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 15.5 m -49.81 -73.34 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 59.18 17.15 36.74 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 85.7 p -88.6 -13.6 39.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.698 0.285 . . . . 0.0 111.294 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -73.43 130.24 39.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.431 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.18 125.43 38.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -59.93 -28.44 67.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.425 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.5 m -60.08 -42.11 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.6 p-10 . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.682 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.659 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 94.23 163.04 35.69 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -139.19 140.42 37.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.794 0.331 . . . . 0.0 110.366 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.1 mp0 -94.41 30.26 2.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.77 0.795 . . . . 0.0 110.148 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.8 -11.98 15.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.447 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.8 mt -47.51 -24.07 0.77 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.309 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -58.98 -41.74 88.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.331 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 mp -104.42 -40.91 5.9 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.934 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.55 -85.49 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 164.7 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 O-C-N 124.136 0.898 . . . . 0.0 110.905 178.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.88 162.37 14.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.306 0.574 . . . . 0.0 110.699 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 30.5 t -73.31 134.9 44.31 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.544 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.5 -30.07 71.28 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.775 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.1 t -64.11 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.06 -15.47 11.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 110.972 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.33 41.09 8.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.254 0.55 . . . . 0.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -126.19 144.97 50.57 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.196 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -52.57 151.98 3.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.64 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.3 mt -85.87 102.28 13.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.017 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -75.9 160.22 79.14 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.854 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -57.59 -33.16 96.15 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.161 1.907 . . . . 0.0 111.319 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -89.03 -8.17 54.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.449 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -67.78 -24.33 65.31 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.911 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 51.09 73.6 0.95 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.479 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.04 149.43 71.49 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.706 2.27 . . . . 0.0 111.739 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -141.54 141.58 33.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.306 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.8 tp -92.65 129.22 38.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.47 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -85.59 165.37 35.81 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.27 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -62.68 -18.33 63.5 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.175 2.583 . . . . 0.0 112.34 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.64 2.7 55.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.103 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.7 47.68 0.12 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.206 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -133.91 124.75 26.94 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.472 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.9 m -85.06 138.49 32.4 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.987 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -147.98 160.88 42.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.314 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 6.3 m -62.67 151.83 37.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.5 t -58.74 -47.56 84.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.985 0.422 . . . . 0.0 110.582 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.79 -42.44 95.05 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.817 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.8 m -67.07 -23.72 65.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.204 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.56 -32.11 73.62 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.126 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.49 -65.14 3.44 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -64.37 110.5 1.4 Allowed 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.689 2.26 . . . . 0.0 111.492 179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 169.56 -71.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.629 0.581 . . . . 0.0 110.057 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.416 ' N ' ' HD2' ' A' ' 97' ' ' PRO . . . -60.06 -60.18 11.44 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.919 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 96' ' ' ALA . 8.3 Cg_endo -48.7 131.3 24.11 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.491 2.127 . . . . 0.0 112.442 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 48.86 38.47 12.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.621 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.99 134.09 53.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.248 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . 53.08 22.69 2.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.312 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 61.4 m-80 -107.83 108.59 19.85 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.589 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.0 m -63.63 -40.39 96.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 91.5 p -62.39 -38.05 88.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -12.2 66.43 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -64.04 -39.58 94.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.79 0.328 . . . . 0.0 110.547 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 148.72 -168.41 29.27 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.39 172.59 41.71 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.45 -39.91 92.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.718 0.294 . . . . 0.0 110.709 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -112.5 143.58 43.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.681 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 101.23 174.86 28.84 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.37 73.55 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.026 0.441 . . . . 0.0 110.628 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 102.98 -13.44 56.06 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.0 p -114.68 -118.94 0.31 Allowed 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.7 m -61.3 141.83 16.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 -179.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.5 t -107.74 134.01 50.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.117 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -81.37 108.66 15.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.968 0.889 . . . . 0.0 110.54 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 121' ' ' LYS . 36.6 t -95.83 131.76 28.55 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.787 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.97 -12.07 14.21 Favored 'Trans proline' 0 C--N 1.297 -2.147 0 C-N-CA 121.003 1.136 . . . . 0.0 112.771 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.44 -61.58 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.504 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 9.3 p -98.7 -25.35 14.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.953 0.406 . . . . 0.0 110.85 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.7 mptt 55.74 32.66 19.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -165.27 137.47 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.03 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -144.6 142.08 29.9 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 98.7 m -70.86 -44.63 66.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.011 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -145.49 178.07 8.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.711 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.54 48.86 1.52 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.481 0.658 . . . . 0.0 111.516 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.01 -29.7 21.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.282 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -103.86 20.49 18.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.904 0.383 . . . . 0.0 111.392 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.6 pt -62.9 -168.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -35.31 116.5 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 O-C-N 124.054 0.846 . . . . 0.0 110.437 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 161.63 -32.52 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.465 0 O-C-N 124.986 1.429 . . . . 0.0 110.013 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -85.59 60.02 5.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.228 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -97.25 28.59 3.56 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.473 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -59.48 -48.04 83.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.6 mmt -78.83 121.1 24.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.237 0.541 . . . . 0.0 110.844 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -153.35 104.34 2.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.22 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -108.4 -80.93 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.133 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 18.6 p 42.93 80.48 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.339 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 67.03 23.88 73.0 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 54.1 m 56.94 33.6 23.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.732 0.301 . . . . 0.0 110.364 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm -94.98 87.39 4.92 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -158.4 156.66 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.416 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -99.35 126.96 45.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.605 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 64.2 p -86.38 -15.16 41.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.548 179.936 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.703 0 N-CA-C 110.784 -0.927 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 72.91 25.14 74.58 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 65.63 117.57 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.065 0.46 . . . . 0.0 109.799 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.96 19.82 1.31 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.093 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.81 -12.67 7.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.632 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 44.3 mt -47.93 -24.02 0.93 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.461 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -59.39 -41.58 89.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.067 0.46 . . . . 0.0 110.382 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -104.0 -40.43 6.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.869 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.35 -86.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 164.29 -78.95 0.0 OUTLIER 'General case' 0 CA--C 1.527 0.064 0 O-C-N 124.037 0.835 . . . . 0.0 110.823 179.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -106.17 163.09 13.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.315 0.579 . . . . 0.0 110.72 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -76.73 135.1 39.02 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.216 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.86 -37.94 94.93 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.634 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.41 -40.32 83.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -176.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 7.7 p -113.07 -17.79 12.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.956 0.408 . . . . 0.0 110.939 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.23 41.31 8.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.368 179.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -129.76 147.8 51.57 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.161 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.8 tpp85 -54.26 144.74 19.39 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.941 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.9 mt -75.53 102.85 5.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.24 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -78.83 164.28 56.13 Favored Pre-proline 0 C--N 1.331 -0.207 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.86 -48.28 17.23 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 C-N-CA 121.44 1.427 . . . . 0.0 112.668 -178.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -72.2 -4.87 31.89 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.968 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -67.34 -25.14 65.85 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.777 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 51.78 72.11 1.3 Allowed Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.255 -178.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.81 148.2 76.57 Favored 'Trans proline' 0 C--N 1.297 -2.157 0 C-N-CA 122.711 2.274 . . . . 0.0 112.102 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -139.52 160.89 38.8 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.161 -178.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.2 tp -115.31 127.85 55.71 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.013 0.435 . . . . 0.0 111.019 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.3 mp -87.39 164.59 34.75 Favored Pre-proline 0 N--CA 1.467 0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.097 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.57 -6.67 19.63 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 123.061 2.508 . . . . 0.0 112.408 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -94.5 0.1 55.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 78.33 41.67 0.11 Allowed 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.947 0.779 . . . . 0.0 111.221 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 33.8 m170 -134.79 123.94 24.36 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.515 178.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.5 m -86.83 143.49 27.45 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.828 -0.749 . . . . 0.0 109.719 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -150.49 164.48 35.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.992 -179.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 21.1 m -66.85 151.08 48.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.181 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.3 p -61.8 -42.24 98.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.616 0.722 . . . . 0.0 109.878 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.46 95.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.268 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.92 -31.85 69.83 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.775 0.798 . . . . 0.0 109.963 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.46 -37.14 86.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.429 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.64 -62.31 4.94 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 120.508 -0.853 . . . . 0.0 111.203 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.21 -22.6 66.89 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 122.08 1.854 . . . . 0.0 111.467 179.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.65 -38.9 82.67 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.934 179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.43 118.33 66.29 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.962 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -55.82 141.5 85.04 Favored 'Trans proline' 0 N--CA 1.499 1.828 0 C-N-CA 121.966 1.777 . . . . 0.0 112.381 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -90.64 -25.01 20.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.68 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.54 139.54 33.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -141.35 137.92 32.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 0.0 110.756 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.5 t-20 -62.35 -40.37 96.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.615 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.3 t 68.04 45.62 1.3 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.236 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.4 t -150.85 150.14 30.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.411 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.77 17.18 75.78 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.484 -0.646 . . . . 0.0 111.484 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 44.5 t0 55.62 60.04 3.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.652 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 95.69 16.42 39.46 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.5 -0.21 71.99 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.601 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.35 139.04 56.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.975 0.388 . . . . 0.0 110.483 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.2 -40.03 94.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.76 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -140.39 173.19 23.18 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.6 t0 74.57 83.24 0.11 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.895 0.409 . . . . 0.0 111.957 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.3 -9.44 45.78 Favored Glycine 0 CA--C 1.519 0.294 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.1 t -116.69 -118.57 0.32 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.33 151.53 4.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.358 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.7 t -112.71 135.36 52.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.099 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -77.62 104.22 8.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.55 0.69 . . . . 0.0 109.553 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 121' ' ' LYS . 13.1 t -100.13 116.99 64.02 Favored Pre-proline 0 C--O 1.204 -1.296 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.637 -179.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -53.2 -16.06 6.24 Favored 'Trans proline' 0 C--N 1.297 -2.142 0 CA-C-N 121.068 1.417 . . . . 0.0 113.47 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 23.3 t -79.03 -62.11 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.742 -178.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.8 p -99.73 -29.13 12.82 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.463 0.649 . . . . 0.0 109.826 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.429 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.4 OUTLIER 63.94 33.1 12.69 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.22 178.78 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -164.63 138.6 5.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.998 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -145.4 165.57 28.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.993 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.3 m -95.92 -50.99 4.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.357 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -142.45 176.24 9.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.736 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.37 34.48 4.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.428 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.5 ptmt -77.18 -22.53 52.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.21 22.3 14.91 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.448 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.403 HG23 HD13 ' A' ' 129' ' ' ILE . 45.5 pt -65.98 -168.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -36.39 115.32 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 O-C-N 124.066 0.854 . . . . 0.0 110.666 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 164.19 -31.76 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 124.914 1.384 . . . . 0.0 109.871 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -86.14 60.19 6.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.934 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -91.31 36.96 0.93 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.712 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.87 -48.4 81.52 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.235 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.0 mmt -84.49 139.32 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.071 0.462 . . . . 0.0 111.029 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -148.35 48.58 1.04 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.508 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.07 159.28 15.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.534 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.3 p -161.56 -39.4 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.821 0.344 . . . . 0.0 110.949 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 80.77 -3.96 72.24 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 86.1 p -107.84 4.33 25.35 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.726 -0.279 . . . . 0.0 110.884 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -64.27 130.34 43.47 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.983 0.421 . . . . 0.0 110.763 -179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.28 145.19 55.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.394 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -144.21 148.93 35.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.479 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 63.5 p -130.91 160.47 34.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.509 -179.992 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -89.39 37.42 0.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 110.504 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.63 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -63.44 -12.32 30.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.773 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.466 HD23 ' HG3' ' A' ' 63' ' ' GLU . 37.5 mt -49.66 -23.11 1.56 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.125 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -59.46 -44.26 93.03 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.872 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 71.5 mt -104.74 -41.28 5.7 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.621 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.56 -88.04 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.63 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 167.33 -78.92 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.081 0 O-C-N 123.706 0.629 . . . . 0.0 110.92 179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -114.12 167.02 11.04 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.243 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.437 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.5 t -78.24 135.29 37.55 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.49 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.06 -38.71 94.29 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 121.564 -0.35 . . . . 0.0 113.068 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.08 -43.35 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.2 p -107.11 -18.74 13.81 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.865 0.364 . . . . 0.0 111.605 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.47 40.28 8.42 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.294 0.568 . . . . 0.0 110.491 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -130.84 146.77 52.37 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.175 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -52.17 149.23 5.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.601 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.44 HD23 ' HG2' ' A' ' 76' ' ' ARG . 73.6 mt -79.57 105.83 11.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.714 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -85.39 167.25 26.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.94 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.69 -51.57 10.82 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.476 1.451 . . . . 0.0 112.625 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.25 -5.03 33.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.522 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.44 ' HG2' HD23 ' A' ' 72' ' ' LEU . 1.6 tpm_? -66.67 -26.12 66.89 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.838 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 46.71 70.06 2.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 O-C-N 123.584 0.553 . . . . 0.0 109.614 -178.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.423 ' HB3' HD13 ' A' ' 72' ' ' LEU . 36.3 Cg_endo -66.18 145.06 77.47 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.923 2.415 . . . . 0.0 111.697 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -141.93 143.72 33.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.37 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.94 123.51 45.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.839 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.486 HD11 HD22 ' A' ' 92' ' ' LEU . 6.5 mp -83.55 168.19 23.81 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.605 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.471 ' CD ' HD12 ' A' ' 129' ' ' ILE . 11.8 Cg_exo -68.17 -14.57 40.96 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 123.154 2.569 . . . . 0.0 112.28 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.2 p -88.48 -0.77 57.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.237 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 75.52 46.37 0.11 Allowed 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 123.832 0.708 . . . . 0.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -134.12 117.53 16.68 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.881 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.0 m -87.59 141.45 28.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.096 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.7 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -156.88 164.59 37.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.805 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.456 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -62.95 137.22 58.21 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.556 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -56.38 -43.18 79.0 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.042 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.1 92.51 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.471 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.2 m -67.26 -33.56 75.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.29 0.567 . . . . 0.0 110.308 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.7 HD21 ' HB3' ' A' ' 87' ' ' ALA . 90.4 mt -68.81 -28.64 66.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.64 -62.3 6.36 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.562 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.27 -19.35 42.06 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 123.071 2.514 . . . . 0.0 111.758 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.12 -37.63 77.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.577 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.455 -179.94 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.364 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.8 t0 68.68 82.93 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.788 0.328 . . . . 0.0 110.721 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.39 -17.1 37.4 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -116.16 -119.33 0.31 Allowed 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.418 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.4 m -63.17 152.72 7.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.962 0.41 . . . . 0.0 110.096 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.703 ' HB ' HD11 ' A' ' 129' ' ' ILE . 82.8 t -127.98 142.06 44.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.745 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -80.52 125.41 29.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.636 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.7 135.47 19.77 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.331 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.68 -11.14 10.84 Favored 'Trans proline' 0 C--N 1.303 -1.868 0 CA-C-N 120.613 1.255 . . . . 0.0 112.939 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 22.3 t -94.35 -60.86 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.574 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.8 p -98.42 -26.37 14.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.975 0.416 . . . . 0.0 110.543 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mptt 57.64 35.24 25.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.978 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.66 144.81 4.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.918 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.04 153.68 40.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.659 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 92.7 m -95.69 -44.55 7.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.181 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -142.47 160.12 40.9 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.31 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.88 27.02 7.42 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.577 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -61.55 -41.46 97.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.452 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -105.32 16.37 25.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.327 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.703 HD11 ' HB ' ' A' ' 115' ' ' VAL . 0.2 OUTLIER -77.57 -176.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.133 -179.467 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.524 ' CG1' HD13 ' A' ' 92' ' ' LEU . 2.6 m -38.76 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.956 0.785 . . . . 0.0 109.762 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 161.97 -21.31 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.894 1.371 . . . . 0.0 111.244 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -106.89 30.46 6.11 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.978 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -42.43 118.42 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.321 0.581 . . . . 0.0 111.314 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -63.45 -51.92 63.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 171.03 -168.53 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.395 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -115.82 92.46 3.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.878 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.34 -10.01 55.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.007 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.9 p . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 120.782 0.325 . . . . 0.0 110.4 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 120.751 0.31 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -90.23 20.3 4.48 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.403 0.62 . . . . 0.0 111.172 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.635 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.52 -12.2 14.21 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.672 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.444 HD23 ' HG3' ' A' ' 63' ' ' GLU . 47.5 mt -49.61 -23.4 1.67 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.281 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -59.66 -42.28 92.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.014 0.435 . . . . 0.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.96 -40.14 6.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.718 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -85.53 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.635 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 167.1 -80.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 O-C-N 123.98 0.8 . . . . 0.0 110.649 179.087 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -109.24 164.67 12.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.55 0.69 . . . . 0.0 110.714 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.501 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 24.1 t -80.22 136.27 36.43 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.092 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.06 -35.6 89.34 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.399 -0.364 . . . . 0.0 112.727 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.75 -39.35 79.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -177.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.4 p -116.59 -17.43 10.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.487 . . . . 0.0 111.409 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.98 40.23 7.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.586 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.99 147.21 50.49 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.161 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -54.26 149.36 9.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.64 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 78' ' ' PRO . 78.2 mt -79.73 109.46 14.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.92 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -73.51 161.41 79.09 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.451 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -57.79 -40.25 80.52 Favored 'Trans proline' 0 N--CA 1.495 1.571 0 C-N-CA 122.261 1.974 . . . . 0.0 111.742 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -89.68 1.25 56.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.223 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.16 -24.8 65.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.943 0.401 . . . . 0.0 111.681 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 54.3 71.76 1.27 Allowed Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.137 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HB3' HD13 ' A' ' 72' ' ' LEU . 60.0 Cg_endo -72.0 152.26 57.03 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 C-N-CA 122.752 2.302 . . . . 0.0 111.085 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.443 ' HD2' HG12 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -139.75 166.95 23.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.307 -179.559 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 tp -118.43 126.78 52.79 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.44 HD11 HD22 ' A' ' 92' ' ' LEU . 3.8 mp -85.67 168.53 19.35 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -67.08 -15.71 47.31 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 123.332 2.688 . . . . 0.0 112.538 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 11.2 p -93.44 1.12 56.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.4 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.02 51.51 0.11 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.38 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.422 ' CE1' HG11 ' A' ' 119' ' ' VAL . 56.2 m170 -128.07 121.46 29.73 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.51 178.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -87.6 132.37 34.09 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.235 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.695 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -150.22 162.04 41.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.803 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -66.51 136.55 55.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -56.57 -42.06 77.96 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.573 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.96 91.59 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.1 m -68.19 -32.99 73.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.239 0.542 . . . . 0.0 110.009 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.695 HD21 ' HB3' ' A' ' 87' ' ' ALA . 93.7 mt -70.78 -26.67 63.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.849 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.66 -60.0 9.78 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.8 -0.715 . . . . 0.0 111.751 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.31 -16.36 34.15 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.95 2.434 . . . . 0.0 111.993 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.3 -38.47 80.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.679 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.385 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.216 179.929 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.349 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.5 t0 77.38 87.23 0.08 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.018 0.437 . . . . 0.0 111.37 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.36 -18.09 39.24 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.6 t -116.81 -122.84 0.29 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.45 149.38 9.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.113 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.462 ' HB ' HD11 ' A' ' 129' ' ' ILE . 59.4 t -123.49 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.729 -179.031 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -67.37 92.01 0.28 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.661 0.743 . . . . 0.0 109.688 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 9.1 t -75.33 132.79 75.48 Favored Pre-proline 0 C--O 1.212 -0.89 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.845 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.98 -14.13 35.4 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 120.803 1.322 . . . . 0.0 112.531 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.422 HG11 ' CE1' ' A' ' 85' ' ' HIS . 6.6 t -94.75 -50.37 11.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.296 -0.562 . . . . 0.0 112.414 -178.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.57 -29.27 10.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.377 0.608 . . . . 0.0 110.095 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 57.48 29.51 17.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.828 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -170.31 100.76 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.523 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -100.47 143.48 30.61 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.175 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.43 -54.29 25.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.564 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -145.18 171.69 14.17 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.121 0.486 . . . . 0.0 110.798 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.565 ' O ' HG22 ' A' ' 129' ' ' ILE . 13.7 p -93.57 8.78 39.44 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.552 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.87 -40.95 97.74 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.474 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -101.17 9.86 41.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.627 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.565 HG22 ' O ' ' A' ' 126' ' ' SER . 0.4 OUTLIER -86.15 -172.1 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.655 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.541 ' CG1' HD13 ' A' ' 92' ' ' LEU . 2.6 m -39.32 104.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 O-C-N 123.504 0.503 . . . . 0.0 110.983 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 162.86 -25.02 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 125.022 1.451 . . . . 0.0 110.56 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -104.6 57.55 0.7 Allowed 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.43 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 6.4 p90 -52.38 141.37 19.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.302 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -102.18 -74.97 0.61 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.368 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.1 ttt -151.26 144.43 24.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.726 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -83.92 62.63 7.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.837 0.351 . . . . 0.0 110.182 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -61.5 139.8 58.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.157 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 -179.42 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -89.33 21.34 3.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.253 0.549 . . . . 0.0 110.947 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.622 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.12 -12.23 18.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.674 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.407 HD23 ' HG3' ' A' ' 63' ' ' GLU . 31.5 mt -49.73 -22.31 1.35 Allowed 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.222 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.02 -44.45 91.73 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.822 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 mt -104.81 -41.47 5.63 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.513 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.34 -89.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.622 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.2 mt-10 165.41 -79.99 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.107 0 O-C-N 123.879 0.737 . . . . 0.0 110.799 179.445 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -106.42 165.74 11.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.181 0.515 . . . . 0.0 110.319 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.441 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 18.9 t -80.02 137.03 36.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.764 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.08 -34.99 82.8 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 121.658 -0.306 . . . . 0.0 112.796 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.99 -42.32 89.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.1 p -111.25 -18.6 12.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.975 0.417 . . . . 0.0 111.234 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 64.17 38.56 8.16 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -128.03 144.32 51.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.207 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 149.37 2.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.395 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.0 mt -78.97 106.9 11.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.641 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.05 157.98 86.28 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.52 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.82 -38.45 95.8 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 121.985 1.79 . . . . 0.0 111.369 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -87.92 -0.59 57.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.308 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.55 -24.67 65.55 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 120.742 0.306 . . . . 0.0 111.703 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 56.56 70.02 1.58 Allowed Pre-proline 0 N--CA 1.442 -0.842 0 CA-C-O 121.405 0.621 . . . . 0.0 109.943 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.91 147.6 74.8 Favored 'Trans proline' 0 C--N 1.301 -1.948 0 C-N-CA 123.052 2.501 . . . . 0.0 111.485 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 mtm-85 -138.02 161.24 37.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.587 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.5 tp -116.97 124.77 50.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.037 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.565 HD11 HD22 ' A' ' 92' ' ' LEU . 5.2 mp -87.99 162.8 39.89 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.414 179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.74 -8.9 24.79 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 123.066 2.511 . . . . 0.0 112.419 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 22.1 p -92.44 2.42 56.68 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.067 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 73.9 41.68 0.4 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.488 0.661 . . . . 0.0 110.989 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -133.32 118.79 18.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.4 m -86.89 139.06 31.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.09 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.704 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -151.66 165.19 35.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.848 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.431 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -70.88 139.35 50.77 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -54.65 -43.41 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.237 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -40.08 92.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.6 m -67.78 -34.73 77.36 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.49 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.704 HD21 ' HB3' ' A' ' 87' ' ' ALA . 82.1 mt -64.93 -31.46 72.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.974 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.7 -63.07 4.4 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.469 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.25 -15.2 46.72 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 122.484 2.122 . . . . 0.0 112.321 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.51 -36.3 75.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.519 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.535 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.323 -179.678 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.242 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 t0 70.87 74.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.848 0.356 . . . . 0.0 110.937 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.17 -17.43 37.61 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -178.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 66.7 p -115.44 -119.31 0.31 Allowed 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.484 0.183 . . . . 0.0 110.513 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.432 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.3 m -59.13 141.97 15.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.214 0.531 . . . . 0.0 110.516 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.9 139.62 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.591 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -84.58 108.18 17.2 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.331 0.586 . . . . 0.0 110.281 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 120' ' ' CYS . 1.6 t -96.61 135.92 22.05 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.414 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -55.16 -18.05 16.78 Favored 'Trans proline' 0 C--N 1.297 -2.144 0 C-N-CA 121.072 1.181 . . . . 0.0 112.86 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.64 -63.09 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.006 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 117' ' ' CYS . 22.4 p -87.62 -28.44 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.86 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 50.53 25.0 1.79 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.851 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -166.53 122.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.845 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -123.91 143.09 50.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.732 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' CYS . . . . . 0.416 ' HG ' ' HD2' ' A' ' 125' ' ' PHE . 50.8 t -63.47 -51.08 67.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.907 0.384 . . . . 0.0 110.721 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.416 ' HD2' ' HG ' ' A' ' 124' ' ' CYS . 2.5 p90 -146.4 176.02 10.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.341 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.519 ' HA ' HG23 ' A' ' 129' ' ' ILE . 59.5 p -108.04 53.56 0.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.775 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -87.42 -40.39 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.742 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.5 22.82 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 111.581 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.519 HG23 ' HA ' ' A' ' 126' ' ' SER . 1.7 pt -62.87 -171.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.432 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -37.9 109.43 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 O-C-N 123.901 0.751 . . . . 0.0 110.393 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 167.96 -30.78 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 124.793 1.308 . . . . 0.0 111.014 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -84.88 72.65 10.75 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 120.296 -0.561 . . . . 0.0 111.068 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -93.39 26.93 2.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -59.93 -47.78 84.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.942 0.401 . . . . 0.0 110.514 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.4 tpt -73.95 125.96 29.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.812 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -144.62 96.35 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.818 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -124.23 144.44 49.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.605 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 p . . . . . 0 C--N 1.331 -0.207 0 CA-C-O 120.917 0.389 . . . . 0.0 111.007 -179.891 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.912 0.387 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -87.94 22.08 2.48 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.555 0.693 . . . . 0.0 111.051 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.604 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.77 -12.22 16.0 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.777 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.437 HD23 ' HG3' ' A' ' 63' ' ' GLU . 44.2 mt -49.46 -22.97 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.181 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.71 -42.9 94.07 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.535 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.92 -40.29 6.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.639 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.28 -86.6 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.604 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 166.94 -78.38 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 O-C-N 123.906 0.754 . . . . 0.0 110.904 179.426 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -106.71 164.58 11.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.351 0.596 . . . . 0.0 110.438 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.2 t -80.94 137.11 36.12 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.869 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.35 -36.11 88.72 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 121.778 -0.248 . . . . 0.0 112.799 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.697 HG22 ' HG2' ' A' ' 118' ' ' PRO . 61.5 t -59.46 -40.04 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 5.6 p -114.19 -18.3 11.66 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.915 0.388 . . . . 0.0 111.128 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 64.14 38.35 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.347 0.594 . . . . 0.0 110.664 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -127.14 144.4 51.04 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.844 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -51.87 150.87 3.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.715 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.542 HD13 ' HB3' ' A' ' 78' ' ' PRO . 92.3 mt -78.02 105.11 9.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.298 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -79.24 166.89 38.74 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.94 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.31 -47.82 24.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.046 1.831 . . . . 0.0 112.982 -177.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -82.2 2.8 29.98 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.508 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.444 ' HG2' HD23 ' A' ' 72' ' ' LEU . 6.4 tpm_? -63.94 -25.76 68.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.311 -178.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.447 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 79.3 tt0 50.73 65.96 6.08 Favored Pre-proline 0 N--CA 1.446 -0.66 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.581 -178.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.542 ' HB3' HD13 ' A' ' 72' ' ' LEU . 22.6 Cg_exo -62.48 150.19 88.33 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 123.161 2.574 . . . . 0.0 112.279 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mtt85 -149.66 147.24 27.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.155 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.04 114.37 28.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.924 0.392 . . . . 0.0 111.264 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -66.37 165.25 24.58 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 121.066 0.46 . . . . 0.0 110.944 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -63.63 -14.71 44.32 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 C-N-CA 123.091 2.527 . . . . 0.0 112.392 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 18.5 p -90.5 2.87 55.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.352 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 75.41 47.94 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.835 0.71 . . . . 0.0 111.373 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -129.95 121.16 26.03 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.649 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -86.77 133.29 33.67 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.122 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.62 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -154.13 167.15 30.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.646 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -69.11 149.73 48.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.342 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -58.88 -44.43 91.12 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.077 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.45 97.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.881 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.3 m -70.0 -28.05 65.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.658 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.62 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.5 OUTLIER -69.09 -34.31 74.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.375 179.478 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.1 -57.97 10.39 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.97 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.92 -11.87 23.27 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.053 1.836 . . . . 0.0 112.832 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.15 -37.44 80.15 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.014 0.435 . . . . 0.0 110.395 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.392 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.788 -179.683 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.451 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.3 t0 73.43 82.38 0.12 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.013 0.435 . . . . 0.0 111.774 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.29 -18.65 35.63 Favored Glycine 0 C--N 1.332 0.332 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.2 t -117.67 -119.99 0.31 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.307 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 123' ' ' GLN . 3.2 m -61.21 155.32 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.941 0.4 . . . . 0.0 110.893 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 73.8 t -119.78 140.1 44.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -84.97 109.3 18.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.811 0.815 . . . . 0.0 111.165 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.1 t -103.5 130.95 22.57 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 114.385 -1.28 . . . . 0.0 109.552 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.697 ' HG2' HG22 ' A' ' 67' ' ' VAL . 36.7 Cg_exo -55.15 -15.4 10.58 Favored 'Trans proline' 0 C--N 1.302 -1.878 0 C-N-CA 121.236 1.291 . . . . 0.0 112.956 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.3 t -92.49 -62.54 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.34 -0.544 . . . . 0.0 112.148 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.6 p -95.49 -26.38 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.565 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 mptt 53.93 24.56 4.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.674 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 tm0? -162.82 128.61 3.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.607 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.411 ' O ' HG12 ' A' ' 114' ' ' VAL . 1.3 mm100 -136.59 139.06 41.86 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' CYS . . . . . 0.437 ' HG ' ' HD2' ' A' ' 125' ' ' PHE . 53.0 t -61.44 -49.4 76.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 110.295 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.437 ' HD2' ' HG ' ' A' ' 124' ' ' CYS . 5.7 p90 -145.04 177.06 9.04 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.415 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 3.8 p -122.29 48.37 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.278 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -87.15 -22.9 25.04 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.992 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -109.13 18.34 20.67 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.872 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.8 pt -64.06 -169.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.812 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.491 HG13 HD23 ' A' ' 92' ' ' LEU . 2.5 m -39.05 104.32 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.281 0 O-C-N 123.867 0.729 . . . . 0.0 110.237 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 162.91 -13.24 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 124.735 1.272 . . . . 0.0 111.427 -178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -90.85 20.33 4.87 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 119.752 -0.779 . . . . 0.0 111.116 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -42.09 105.77 0.05 Allowed 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.54 0.525 . . . . 0.0 110.952 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -85.05 -74.4 0.4 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 55.0 ttp -152.83 148.61 27.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 78.3 mtm-85 -86.28 65.6 9.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.141 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -55.41 125.27 20.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.783 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 p . . . . . 0 C--N 1.333 -0.132 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.781 -179.541 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.47 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.93 0.395 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.84 20.23 4.94 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.499 0.666 . . . . 0.0 110.651 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.87 -11.68 14.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.819 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.426 HD23 ' HG3' ' A' ' 63' ' ' GLU . 45.8 mt -48.27 -23.51 0.91 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.894 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.53 -44.01 93.29 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.713 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 mt -104.44 -41.83 5.63 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.716 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.81 -89.99 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 165.27 -67.72 0.0 OUTLIER 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.93 0.769 . . . . 0.0 111.455 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -118.11 163.85 16.01 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.271 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 5.3 t -81.51 140.04 34.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.993 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.27 -38.65 93.92 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.334 -0.46 . . . . 0.0 113.283 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -59.96 -44.07 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 26.7 p -106.33 -20.38 13.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.931 0.396 . . . . 0.0 111.582 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 65.04 36.03 7.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.503 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.11 146.5 50.68 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.379 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.0 tpp180 -52.02 148.64 5.86 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.466 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.546 HD13 ' HB3' ' A' ' 78' ' ' PRO . 75.6 mt -73.43 101.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.244 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.446 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 3.7 ptm180 -71.4 166.94 34.3 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.753 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -55.39 -43.1 61.64 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.267 1.978 . . . . 0.0 113.172 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.446 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.7 mt-10 -87.06 2.7 48.84 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.431 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.408 ' HG2' HD23 ' A' ' 72' ' ' LEU . 3.7 tpm_? -64.68 -25.66 68.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.677 0.275 . . . . 0.0 111.333 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 47.8 68.92 3.04 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.809 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.546 ' HB3' HD13 ' A' ' 72' ' ' LEU . 38.9 Cg_endo -66.98 140.77 55.75 Favored 'Trans proline' 0 C--N 1.298 -2.122 0 C-N-CA 122.971 2.447 . . . . 0.0 111.791 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -135.22 145.55 47.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.583 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 tp -100.29 122.18 42.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.417 HD11 HD22 ' A' ' 92' ' ' LEU . 2.2 mp -81.31 166.31 39.15 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.82 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -61.93 -16.68 51.2 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 123.015 2.476 . . . . 0.0 112.139 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.7 p -88.49 -1.22 57.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.403 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.27 45.66 0.19 Allowed 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 123.758 0.661 . . . . 0.0 110.998 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -129.71 122.23 28.5 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.443 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -86.52 138.06 32.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.217 -179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.609 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -153.46 165.64 35.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.731 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -68.73 138.77 55.16 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -56.28 -42.5 77.58 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.025 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.07 92.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 87.1 m -65.81 -36.39 83.36 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.156 0.503 . . . . 0.0 110.349 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.609 HD21 ' HB3' ' A' ' 87' ' ' ALA . 92.0 mt -66.72 -29.66 69.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.173 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.32 -60.67 6.06 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.79 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.57 -16.5 55.02 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.188 1.925 . . . . 0.0 112.452 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.58 -24.59 65.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.655 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.694 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -177.42 58.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.09 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 101.82 -15.96 56.47 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 -179.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 81.3 p -107.07 -121.23 0.24 Allowed 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.289 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 26.5 m -60.5 141.72 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-O 121.137 0.494 . . . . 0.0 109.94 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 50.6 t -107.47 131.12 58.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.581 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 49.4 p-10 -79.29 84.54 5.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.072 0.939 . . . . 0.0 109.901 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.61 137.08 77.37 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.822 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -55.34 -18.69 19.57 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 CA-C-N 120.21 1.111 . . . . 0.0 113.182 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.7 t -95.58 -63.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.479 -0.489 . . . . 0.0 112.202 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 20.7 p -86.6 -28.76 23.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.678 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 49.55 26.14 1.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.975 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -165.31 119.82 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.592 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -123.33 171.19 9.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.621 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 96.1 m -94.78 -51.94 4.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.478 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -145.02 174.98 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.606 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.516 ' HB2' HD13 ' A' ' 129' ' ' ILE . 64.8 p -108.43 50.12 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.054 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.05 -38.75 15.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.567 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.13 19.09 20.88 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.871 0.367 . . . . 0.0 111.774 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.516 HD13 ' HB2' ' A' ' 126' ' ' SER . 8.6 pt -61.41 -170.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.731 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.3 m -38.89 105.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 O-C-N 123.817 0.698 . . . . 0.0 110.547 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 174.91 -34.21 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.583 0 O-C-N 124.286 0.991 . . . . 0.0 110.812 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -84.51 72.53 10.63 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.815 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -68.76 138.14 54.61 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.936 0.398 . . . . 0.0 111.161 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -107.46 -177.09 3.25 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.39 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 98.2 mtp -62.0 149.53 40.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.233 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -79.37 59.3 2.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.201 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -62.05 117.43 5.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.321 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.47 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 85.1 p . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.693 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -89.54 24.89 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.566 0.698 . . . . 0.0 111.064 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.673 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.69 -12.05 14.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.65 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.404 HD23 ' HG3' ' A' ' 63' ' ' GLU . 39.6 mt -48.65 -23.3 0.98 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.171 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.55 -43.08 93.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.01 0.433 . . . . 0.0 110.641 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.8 mt -104.39 -40.61 6.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.647 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.36 -86.71 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.673 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 166.55 -81.02 0.0 OUTLIER 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.79 0.681 . . . . 0.0 110.96 179.088 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.5 p-80 -113.35 163.21 15.14 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.34 0.591 . . . . 0.0 110.416 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 12.8 t -76.11 134.47 39.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.159 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -36.92 92.88 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 116.407 -0.36 . . . . 0.0 112.9 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.5 t -60.04 -42.59 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 22.2 p -110.83 -18.16 13.17 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 63.72 37.84 9.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.391 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -125.31 145.89 49.81 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.773 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -52.67 147.44 8.63 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.26 109.79 8.03 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.874 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -77.71 157.51 79.46 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.112 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.34 -33.76 94.09 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.603 1.535 . . . . 0.0 111.249 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -90.4 -2.08 57.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.375 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -23.91 65.96 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 111.655 -178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.41 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 85.9 tt0 56.12 66.95 3.12 Favored Pre-proline 0 N--CA 1.446 -0.639 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.857 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.41 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.0 Cg_exo -61.99 146.93 96.06 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.995 2.463 . . . . 0.0 111.995 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -140.44 148.15 40.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.417 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 tp -102.69 130.0 49.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.173 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -89.28 166.58 20.89 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 121.081 0.467 . . . . 0.0 111.21 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.43 -20.72 69.59 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 123.268 2.645 . . . . 0.0 112.691 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.6 p -87.42 0.78 55.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.047 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 74.67 47.48 0.12 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.892 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.481 ' CE1' HG11 ' A' ' 119' ' ' VAL . 45.6 m170 -129.6 123.98 32.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.151 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -86.64 131.47 34.14 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.257 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.646 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -144.11 162.52 36.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.485 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.09 149.12 48.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.344 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 t -60.04 -46.52 89.24 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.396 0.617 . . . . 0.0 110.199 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.99 95.58 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.785 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.6 m -70.08 -25.8 63.69 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.959 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.646 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.2 OUTLIER -69.89 -34.36 73.44 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.542 179.623 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -52.99 -58.68 10.94 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.815 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.77 -18.63 21.91 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 123.008 2.472 . . . . 0.0 112.582 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.05 -36.68 75.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.788 0.327 . . . . 0.0 110.344 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.053 179.827 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.293 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.4 t0 74.08 81.37 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.889 0.376 . . . . 0.0 110.572 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.0 -18.13 37.15 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 67.6 p -115.57 -118.85 0.32 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.423 ' O ' HG23 ' A' ' 114' ' ' VAL . 21.3 m -60.68 132.95 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.164 0.507 . . . . 0.0 110.312 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.53 131.27 56.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.066 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -71.14 135.56 47.69 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.591 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.466 ' O ' ' N ' ' A' ' 121' ' ' LYS . 24.3 t -115.75 132.86 22.95 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.814 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -54.33 -17.83 13.04 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 CA-C-N 120.794 1.319 . . . . 0.0 112.493 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.481 HG11 ' CE1' ' A' ' 85' ' ' HIS . 2.7 t -94.38 -50.54 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.48 -31.31 11.35 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.452 0.644 . . . . 0.0 110.265 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.3 mptt 57.65 26.98 13.59 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.831 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -169.64 110.44 0.44 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.779 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -103.25 160.51 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.683 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 74.7 m -93.46 -44.42 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -145.3 167.78 22.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.534 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.564 ' HB2' HD13 ' A' ' 129' ' ' ILE . 51.3 p -105.16 44.45 1.03 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -88.42 -36.34 16.57 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -108.29 21.25 17.59 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.564 HD13 ' HB2' ' A' ' 126' ' ' SER . 13.3 pt -70.33 -170.02 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.424 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.501 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.7 OUTLIER -38.73 108.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 O-C-N 123.782 0.676 . . . . 0.0 110.39 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.1 -27.33 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 124.613 1.196 . . . . 0.0 110.772 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -84.41 74.46 10.36 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.753 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -85.67 114.02 22.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.031 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -96.79 -179.68 4.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.307 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 17.0 ptm -49.33 159.9 0.28 Allowed 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -98.36 80.24 2.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.446 -179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -80.7 106.61 12.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.553 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.452 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.42 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.506 ' HB3' ' HE ' ' A' ' 71' ' ' ARG . . . . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.83 0.348 . . . . 0.0 110.317 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -92.03 21.87 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.461 0.648 . . . . 0.0 110.847 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.606 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.04 -12.42 11.69 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.815 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.455 HD23 ' HG3' ' A' ' 63' ' ' GLU . 35.5 mt -49.58 -23.64 1.76 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.347 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.39 -43.27 92.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 68.5 mt -104.19 -40.62 6.07 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.936 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.8 -87.87 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.606 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.0 OUTLIER 165.79 -79.28 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 O-C-N 124.06 0.85 . . . . 0.0 110.969 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -108.26 164.43 12.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.166 0.508 . . . . 0.0 110.513 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.518 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 10.6 t -76.17 135.03 39.76 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.931 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.41 -37.8 94.2 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 121.442 -0.409 . . . . 0.0 113.011 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.8 t -62.02 -42.71 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.53 -16.05 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.03 0.443 . . . . 0.0 110.962 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.12 29.22 16.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.415 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -114.89 143.83 44.51 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.496 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.506 ' HE ' ' HB3' ' A' ' 56' ' ' ALA . 33.2 ttt180 -54.4 151.35 7.71 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.769 -178.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.54 104.2 8.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.192 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -77.34 157.22 80.82 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.363 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -56.16 -38.65 94.58 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 C-N-CA 121.787 1.658 . . . . 0.0 111.064 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -86.86 -1.88 58.15 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.898 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -67.86 -24.24 65.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.982 0.42 . . . . 0.0 111.134 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.431 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 78.5 tt0 57.65 65.71 3.3 Favored Pre-proline 0 N--CA 1.445 -0.705 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.296 -178.224 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.5 Cg_exo -63.05 146.45 94.59 Favored 'Trans proline' 0 C--N 1.301 -1.931 0 C-N-CA 122.367 2.044 . . . . 0.0 111.221 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -140.15 148.79 42.15 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.294 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.6 tp -103.38 127.53 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.142 0.496 . . . . 0.0 111.445 -178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 92' ' ' LEU . 4.4 mp -89.77 164.62 28.2 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.234 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.41 -6.73 19.8 Favored 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 123.037 2.491 . . . . 0.0 112.532 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 20.0 p -94.11 -0.87 55.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.404 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 77.46 41.52 0.14 Allowed 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 123.926 0.766 . . . . 0.0 110.969 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.479 ' NE2' HG11 ' A' ' 119' ' ' VAL . 33.4 m170 -134.58 119.2 18.11 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.679 178.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.5 m -87.02 140.26 29.74 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.712 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -152.41 164.1 38.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.578 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -65.34 137.59 57.62 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -56.32 -43.43 78.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.516 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.74 91.12 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 84.2 m -67.48 -33.55 75.34 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.53 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.712 HD21 ' HB3' ' A' ' 87' ' ' ALA . 74.7 mt -65.53 -37.33 86.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.04 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -47.57 -63.71 3.28 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.78 -27.03 69.47 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.882 2.388 . . . . 0.0 111.787 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.02 -39.67 86.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.559 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.531 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.054 179.447 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.9 t0 70.23 76.2 0.2 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.924 0.392 . . . . 0.0 110.972 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.64 -13.16 46.77 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.4 p -115.99 -120.64 0.3 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.549 -0.325 . . . . 0.0 110.451 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.0 m -64.24 151.66 9.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.058 0.456 . . . . 0.0 110.673 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.89 133.89 65.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.819 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.23 113.71 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.151 0.501 . . . . 0.0 110.025 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.96 138.31 19.77 Favored Pre-proline 0 C--O 1.213 -0.828 0 CA-C-N 115.228 -0.897 . . . . 0.0 108.832 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.66 -15.41 48.58 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 121.165 1.243 . . . . 0.0 112.58 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.479 HG11 ' NE2' ' A' ' 85' ' ' HIS . 52.1 t -94.46 -61.99 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.576 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -90.45 -24.85 20.6 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.433 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.7 mptt 49.75 24.25 1.2 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.839 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.13 116.37 0.84 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -118.38 156.97 28.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.615 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 6.4 t -83.46 -49.95 8.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.15 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -141.19 176.8 8.55 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.489 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.03 50.79 1.11 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.56 0.695 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -85.03 -26.84 26.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.462 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.421 ' OD1' ' ND2' ' A' ' 132' ' ' ASN . 3.3 t70 -113.62 23.72 12.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 111.43 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 15.3 pt -60.16 -172.34 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.784 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.406 HG12 ' CD1' ' A' ' 92' ' ' LEU . 2.5 m -41.24 104.58 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 O-C-N 123.758 0.662 . . . . 0.0 110.698 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.38 -33.52 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.405 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.421 ' ND2' ' OD1' ' A' ' 128' ' ' ASP . 9.7 m120 -82.96 68.57 9.5 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.573 -178.205 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -95.67 32.73 1.77 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -61.71 -39.04 90.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.55 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.7 mmt -95.14 127.61 41.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.104 0.478 . . . . 0.0 110.9 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -136.51 45.4 2.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.754 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -62.8 145.2 55.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.636 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.558 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.456 -0.125 0 CA-C-O 120.813 0.339 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -89.27 12.39 16.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -58.97 -11.29 3.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.11 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.478 HD23 ' HG3' ' A' ' 63' ' ' GLU . 55.1 mt -47.39 -28.15 1.96 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.515 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -49.26 -45.98 45.61 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.67 -40.84 5.86 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.599 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.1 -83.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 123.432 0.457 . . . . 0.0 109.777 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.617 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.9 OUTLIER 164.65 -76.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.091 0.869 . . . . 0.0 111.303 179.383 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 -103.06 165.2 11.16 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.386 0.612 . . . . 0.0 110.41 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 20.2 t -81.35 135.94 35.71 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.205 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.09 92.67 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 116.521 -0.308 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.37 -41.16 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 4.4 p -113.56 -16.16 12.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.923 0.392 . . . . 0.0 111.16 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 62.99 38.83 10.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.319 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -128.1 145.28 51.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.098 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -51.69 153.78 2.25 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.336 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 78' ' ' PRO . 85.5 mt -82.56 102.42 11.39 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.863 -178.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -66.56 162.17 52.73 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.151 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.31 -39.24 86.06 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 121.924 1.75 . . . . 0.0 111.05 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -90.17 0.81 56.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.512 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -66.88 -23.74 66.04 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.126 0.489 . . . . 0.0 110.784 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 50.61 74.51 0.79 Allowed Pre-proline 0 N--CA 1.45 -0.429 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.583 ' HB3' HD13 ' A' ' 72' ' ' LEU . 65.7 Cg_endo -70.71 152.81 64.67 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 123.03 2.487 . . . . 0.0 112.283 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -147.14 152.43 38.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.656 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 tp -108.92 128.41 54.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.313 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -83.84 165.58 38.66 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.295 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -62.4 -16.7 53.37 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 123.126 2.551 . . . . 0.0 112.251 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.5 p -88.42 -0.9 57.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.4 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.34 49.17 0.07 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.432 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -133.99 124.02 25.59 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.605 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.4 m -86.52 140.28 30.06 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.307 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.584 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -156.08 163.83 39.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.916 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.3 m -65.14 149.87 49.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.211 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.3 t -59.99 -46.35 89.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.645 0.736 . . . . 0.0 109.796 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.23 96.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.271 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 99.4 m -69.88 -26.79 64.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 109.729 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.584 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -66.9 -38.25 85.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.696 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.9 -60.17 7.31 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.81 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.21 -29.29 37.15 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 123.283 2.655 . . . . 0.0 112.372 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.84 -38.4 81.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.186 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.04 179.628 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.348 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t0 71.95 79.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.892 0.377 . . . . 0.0 111.006 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.58 -16.43 40.77 Favored Glycine 0 N--CA 1.453 -0.213 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.5 p -114.91 -120.55 0.3 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.647 -0.276 . . . . 0.0 110.356 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.413 ' H ' HG13 ' A' ' 114' ' ' VAL . 2.7 m -66.96 138.33 23.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.415 -179.34 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.1 t -110.47 132.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.8 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 122.52 25.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.731 0.777 . . . . 0.0 109.944 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 49.7 t -108.94 135.52 20.13 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.655 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.41 -11.19 15.64 Favored 'Trans proline' 0 C--N 1.302 -1.897 0 C-N-CA 121.084 1.19 . . . . 0.0 112.679 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -93.97 -62.41 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.648 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 10.2 p -96.8 -24.73 15.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.936 0.398 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 54.73 29.54 11.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.808 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -156.48 139.03 14.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.118 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -141.64 158.42 43.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.714 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 34.6 t -94.66 -55.04 3.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.169 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -144.0 175.18 10.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.564 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.531 ' HA ' HG23 ' A' ' 129' ' ' ILE . 78.9 p -104.46 54.24 0.73 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.674 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -87.62 -43.03 12.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.528 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -107.8 19.23 20.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.667 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.531 HG23 ' HA ' ' A' ' 126' ' ' SER . 3.7 pt -59.02 -172.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.624 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.477 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -39.33 112.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 O-C-N 123.827 0.704 . . . . 0.0 110.608 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 165.74 -29.62 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 124.621 1.201 . . . . 0.0 110.713 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -87.64 101.14 13.36 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.742 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 48.2 p90 -108.37 143.63 37.02 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.608 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -108.66 -81.01 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 16.8 tpt -145.09 141.24 28.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -89.27 44.55 1.22 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.742 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -81.82 146.41 29.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.686 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 52.7 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 71' ' ' ARG . . . . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.12 0.486 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -88.93 30.72 0.91 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.442 0.639 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.634 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.92 -12.5 18.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.529 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.438 HD23 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mt -49.23 -23.63 1.43 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.242 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -59.24 -43.21 92.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.989 0.423 . . . . 0.0 110.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.0 mt -104.3 -40.64 6.04 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.94 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.27 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.634 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.9 OUTLIER 165.12 -79.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 O-C-N 123.987 0.804 . . . . 0.0 110.978 178.974 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -106.2 166.4 10.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.239 0.542 . . . . 0.0 110.688 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.6 t -79.2 135.34 36.77 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.259 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.28 -37.91 93.28 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.615 -0.326 . . . . 0.0 112.851 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.32 -41.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.0 p -110.04 -18.07 13.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.95 0.405 . . . . 0.0 111.204 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.34 39.67 9.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.53 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -128.76 144.1 51.08 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.123 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.562 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 7.8 ttm180 -50.7 152.6 1.97 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.366 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -81.14 112.47 18.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.977 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -82.78 158.38 65.35 Favored Pre-proline 0 N--CA 1.462 0.162 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.394 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.12 -40.24 86.15 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.063 1.842 . . . . 0.0 111.831 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -85.97 -0.32 55.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.43 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -67.51 -24.99 65.63 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 111.482 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.435 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 81.9 tt0 56.27 65.72 3.97 Favored Pre-proline 0 N--CA 1.444 -0.766 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.841 -177.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.435 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.4 Cg_exo -63.08 147.34 94.43 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.736 2.291 . . . . 0.0 111.545 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.432 ' HD3' HG23 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -143.69 149.54 37.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.241 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.99 123.56 48.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.119 0.485 . . . . 0.0 112.154 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.586 HD11 HD22 ' A' ' 92' ' ' LEU . 2.7 mp -77.37 165.73 49.52 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.626 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -64.84 -16.17 54.03 Favored 'Trans proline' 0 C--N 1.307 -1.61 0 C-N-CA 123.245 2.63 . . . . 0.0 112.16 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 9.9 p -91.12 1.4 57.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.101 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 75.76 49.81 0.07 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.566 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.44 ' CD2' HG11 ' A' ' 119' ' ' VAL . 32.7 m170 -134.14 125.43 27.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.752 178.091 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.8 m -85.58 142.46 29.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.084 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.691 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -156.52 163.06 39.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.673 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.6 m -69.61 135.36 49.87 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.433 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.2 t -56.23 -39.8 73.09 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.634 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.97 88.38 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.7 m -67.24 -36.84 82.49 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.624 0.725 . . . . 0.0 110.215 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.691 HD21 ' HB3' ' A' ' 87' ' ' ALA . 73.3 mt -64.29 -35.96 82.54 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.776 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.47 -62.92 4.06 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.726 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.97 -21.4 27.89 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.512 2.142 . . . . 0.0 112.03 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.443 ' O ' HG13 ' A' ' 115' ' ' VAL . . . -68.57 75.96 0.28 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.475 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.95 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.9 t0 63.45 70.19 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.945 0.402 . . . . 0.0 110.8 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.03 -8.51 38.89 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.6 p -116.16 -120.09 0.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.405 ' H ' HG13 ' A' ' 114' ' ' VAL . 2.4 m -62.72 145.11 13.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.074 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 95' ' ' ALA . 90.6 t -112.09 133.29 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.21 0.528 . . . . 0.0 111.63 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -74.22 106.42 5.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.829 0.824 . . . . 0.0 110.057 179.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 121' ' ' LYS . 7.6 t -104.05 126.99 30.21 Favored Pre-proline 0 C--O 1.202 -1.406 0 CA-C-N 114.756 -1.111 . . . . 0.0 108.63 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.32 -9.08 22.54 Favored 'Trans proline' 0 C--N 1.296 -2.226 0 CA-C-N 121.188 1.46 . . . . 0.0 113.171 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.44 HG11 ' CD2' ' A' ' 85' ' ' HIS . 40.5 t -85.82 -54.88 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.147 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.4 p -105.49 -27.79 11.2 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.118 0.485 . . . . 0.0 110.482 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 0.3 OUTLIER 62.05 35.9 15.7 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.209 178.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -166.74 141.84 4.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -150.22 158.75 44.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.638 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 79.2 m -96.04 -47.38 6.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.438 . . . . 0.0 110.089 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -142.61 176.45 9.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.355 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.55 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.6 OUTLIER -120.87 46.74 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.374 179.601 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.23 -30.45 19.69 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.349 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -106.19 16.74 24.5 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.55 HD13 ' HB2' ' A' ' 126' ' ' SER . 44.5 pt -70.95 -169.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.99 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.432 HG23 ' HD3' ' A' ' 79' ' ' ARG . 0.2 OUTLIER -41.67 109.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 O-C-N 123.727 0.642 . . . . 0.0 110.075 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 163.92 -34.25 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 124.827 1.33 . . . . 0.0 111.072 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -59.59 -42.23 92.08 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 75.9 t80 37.9 73.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.965 0.79 . . . . 0.0 111.193 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.76 -50.3 74.36 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.99 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.3 ttt 178.03 -165.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.385 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.7 mtm180 -116.6 92.81 3.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.807 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.93 -36.62 79.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.922 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 121.001 0.429 . . . . 0.0 110.449 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -86.74 26.59 1.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.49 0.662 . . . . 0.0 110.709 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.15 -12.1 11.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.584 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.438 HD23 ' HG3' ' A' ' 63' ' ' GLU . 46.3 mt -47.48 -23.8 0.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.989 179.142 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -59.66 -43.09 94.07 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.643 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.0 mt -103.96 -40.95 6.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.366 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.46 -88.28 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.683 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.4 mt-10 164.6 -81.17 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.85 0.718 . . . . 0.0 110.891 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -102.22 168.91 9.05 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.095 0.474 . . . . 0.0 110.134 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.423 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 12.4 t -84.34 138.43 32.89 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.032 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.28 -36.41 89.55 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.584 -0.341 . . . . 0.0 113.075 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.7 t -59.61 -43.16 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.7 p -109.0 -20.53 13.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.968 0.414 . . . . 0.0 111.305 -178.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 65.62 34.26 7.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.421 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -126.42 145.69 50.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.119 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 9.6 ttm-85 -49.71 149.75 2.37 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.531 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.18 115.58 14.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.772 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -80.75 162.08 61.53 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.507 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.27 -38.08 46.41 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 121.791 1.66 . . . . 0.0 111.585 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.65 0.61 57.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.821 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -24.28 66.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.91 0.386 . . . . 0.0 111.522 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 55.92 69.0 2.04 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-O 121.289 0.566 . . . . 0.0 110.206 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.54 151.68 70.36 Favored 'Trans proline' 0 C--N 1.299 -2.027 0 C-N-CA 123.442 2.762 . . . . 0.0 111.963 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -144.87 167.01 23.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.821 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.38 126.26 51.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.569 HD11 HD22 ' A' ' 92' ' ' LEU . 3.9 mp -86.63 164.68 36.39 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.278 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.46 -6.0 18.06 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.926 2.417 . . . . 0.0 112.063 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -94.33 2.34 55.83 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.333 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 76.42 39.15 0.27 Allowed 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.513 0.673 . . . . 0.0 111.222 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.494 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.1 m170 -134.5 120.29 19.52 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.944 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.9 m -86.56 142.83 28.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.779 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -154.13 167.41 29.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.882 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.437 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -71.32 136.13 47.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.6 t -53.04 -42.96 66.25 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.92 91.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.2 m -68.44 -33.58 74.45 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.659 0.742 . . . . 0.0 110.495 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.779 HD21 ' HB3' ' A' ' 87' ' ' ALA . 70.4 mt -63.97 -36.37 83.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.162 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.77 -65.27 2.94 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.97 -29.73 74.8 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.016 2.477 . . . . 0.0 111.551 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.69 -38.17 77.67 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.463 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.459 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.461 179.656 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.54 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.7 t0 67.89 83.84 0.16 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 110.924 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.42 -18.26 35.81 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.7 p -115.22 -120.71 0.3 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.656 -0.272 . . . . 0.0 110.318 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.431 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.0 m -63.17 142.94 16.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.936 0.398 . . . . 0.0 110.203 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 96.7 t -113.48 139.95 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.253 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.4 116.17 21.75 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.395 0.617 . . . . 0.0 109.894 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 48.9 t -106.04 133.99 19.96 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.196 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.73 -11.35 11.54 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.272 1.315 . . . . 0.0 113.302 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.494 HG11 ' NE2' ' A' ' 85' ' ' HIS . 15.0 t -94.59 -62.14 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.475 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.7 p -97.14 -26.55 14.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.017 0.436 . . . . 0.0 110.568 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.6 mptt 56.25 27.51 11.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.707 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -160.37 136.24 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.947 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -141.6 161.81 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.67 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' CYS . . . . . 0.564 ' HG ' ' HD1' ' A' ' 125' ' ' PHE . 11.7 p -95.28 -43.81 7.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.363 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.564 ' HD1' ' HG ' ' A' ' 124' ' ' CYS . 50.8 m-85 -143.26 177.08 8.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.896 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.445 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.2 OUTLIER -119.99 53.53 1.07 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 111.58 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -88.65 -30.34 19.25 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.699 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -112.62 23.06 13.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.615 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.445 HD13 ' HB2' ' A' ' 126' ' ' SER . 18.0 pt -70.15 -172.95 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 120.882 0.372 . . . . 0.0 111.35 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -45.25 106.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.574 179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 163.87 -40.1 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 124.973 1.421 . . . . 0.0 111.106 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -89.99 72.88 7.41 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.691 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 p90 -68.14 143.56 55.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.108 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -78.38 0.57 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.395 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.0 mmm -129.42 147.11 51.21 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.616 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.6 mtm-85 -110.31 42.17 1.61 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.454 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -73.15 153.14 40.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.641 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.611 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 79.2 p . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.878 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.884 0.373 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -86.38 42.54 1.0 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.653 0.739 . . . . 0.0 110.73 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.715 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.85 -13.3 23.09 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.999 -1.0 . . . . 0.0 111.366 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.441 HD23 ' HG3' ' A' ' 63' ' ' GLU . 32.3 mt -47.31 -24.58 0.79 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.411 0.444 . . . . 0.0 110.969 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -60.28 -44.35 95.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.989 0.423 . . . . 0.0 110.806 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 80' ' ' LEU . 83.1 mt -103.58 -42.63 5.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.658 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.07 -90.63 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.715 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.4 OUTLIER 166.22 -80.13 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.703 0.801 . . . . 0.0 111.298 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -107.59 165.42 11.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.359 0.6 . . . . 0.0 110.346 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.426 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 40.9 t -79.62 147.76 31.93 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.606 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -35.98 40.35 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.187 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 68.1 t -62.57 -37.6 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.932 0.396 . . . . 0.0 111.498 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 -26.19 10.76 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.383 -178.052 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 66.51 24.66 10.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.791 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -122.26 150.3 42.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.236 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -50.91 150.17 3.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.28 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.8 mt -80.59 118.41 22.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.347 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.28 165.72 16.25 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.022 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -52.56 -51.19 11.69 Favored 'Trans proline' 0 C--N 1.303 -1.862 0 C-N-CA 122.164 1.909 . . . . 0.0 112.96 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -72.14 -7.42 49.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.079 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.28 -24.34 64.86 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 121.106 -0.238 . . . . 0.0 110.919 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 49.03 71.64 1.53 Allowed Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 121.075 0.465 . . . . 0.0 110.086 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.58 148.13 82.96 Favored 'Trans proline' 0 C--N 1.295 -2.244 0 C-N-CA 122.819 2.346 . . . . 0.0 112.15 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.39 144.77 32.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.925 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 61' ' ' LEU . 0.6 OUTLIER -100.46 126.09 46.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.094 0.473 . . . . 0.0 111.104 -179.705 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 92' ' ' LEU . 4.6 mp -87.95 164.15 34.96 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.988 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -70.59 -6.77 19.78 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 C-N-CA 122.784 2.323 . . . . 0.0 112.025 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.8 p -94.56 2.52 55.66 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.509 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 74.45 41.59 0.35 Allowed 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.96 0.787 . . . . 0.0 111.074 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.432 ' NE2' HG11 ' A' ' 119' ' ' VAL . 33.6 m170 -134.62 118.15 16.89 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.031 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.46 135.55 33.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.242 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.701 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -149.89 167.46 26.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.512 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.3 m -71.6 135.49 46.99 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.955 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.4 t -51.63 -44.08 62.82 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.491 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.06 92.78 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.589 -0.445 . . . . 0.0 109.946 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 89.6 m -68.29 -33.53 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.698 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.701 HD21 ' HB3' ' A' ' 87' ' ' ALA . 88.7 mt -65.14 -35.43 81.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.486 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -44.29 -64.98 1.82 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.12 -20.74 71.85 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.633 2.222 . . . . 0.0 112.137 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.99 -38.29 85.49 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.032 0.444 . . . . 0.0 109.899 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.631 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.368 -179.916 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.354 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.6 t0 64.5 77.23 0.32 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.737 0.303 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.55 -15.9 45.15 Favored Glycine 0 N--CA 1.452 -0.281 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 -179.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 80.9 p -115.58 -121.14 0.3 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.666 -0.267 . . . . 0.0 110.998 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.403 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.1 m -61.8 143.67 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 120.871 0.367 . . . . 0.0 110.052 -179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 69.5 t -110.99 137.32 43.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.479 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.72 113.44 19.7 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.608 0.718 . . . . 0.0 111.035 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 121' ' ' LYS . 42.7 t -104.11 133.78 20.05 Favored Pre-proline 0 C--N 1.312 -1.042 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.464 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.29 -10.45 8.51 Favored 'Trans proline' 0 C--N 1.301 -1.961 0 C-N-CA 121.682 1.588 . . . . 0.0 113.433 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 85' ' ' HIS . 38.9 t -94.81 -61.82 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.939 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 13.0 p -98.12 -29.5 13.2 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 110.95 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.0 mptt 58.01 28.99 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -161.42 137.29 7.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.717 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -143.85 154.38 43.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.732 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 5.6 t -83.76 -50.05 8.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -139.25 176.98 8.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.869 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.99 45.23 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.735 0.778 . . . . 0.0 111.599 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -86.53 -19.58 29.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.414 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.59 22.63 13.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.999 0.428 . . . . 0.0 110.908 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 25.2 pt -63.71 -170.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.5 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -40.69 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 O-C-N 123.895 0.747 . . . . 0.0 110.66 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 175.38 -31.74 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 124.186 0.929 . . . . 0.0 110.79 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -84.96 71.05 10.97 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.126 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -92.66 31.14 1.4 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.938 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.38 -37.26 80.19 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.425 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 36.5 tpp -82.55 109.33 16.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.799 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.1 mtm180 -152.78 82.97 1.22 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.802 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -119.97 11.39 11.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.019 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 C--N 1.326 -0.415 0 CA-C-O 120.739 0.304 . . . . 0.0 110.241 -179.584 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 121.105 0.478 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -88.22 30.66 0.85 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.432 0.634 . . . . 0.0 110.669 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.633 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.12 -12.47 12.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.51 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.43 HD23 ' HG3' ' A' ' 63' ' ' GLU . 39.5 mt -48.5 -23.76 1.08 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.334 179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.05 -42.65 90.77 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.475 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.9 mt -104.17 -39.98 6.32 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.785 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.2 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.633 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.6 OUTLIER 164.94 -79.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 O-C-N 124.114 0.884 . . . . 0.0 111.045 178.995 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -108.03 166.92 10.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.263 0.554 . . . . 0.0 110.468 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.426 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 10.0 t -77.37 135.66 38.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.309 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.26 -38.22 94.87 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.492 -0.385 . . . . 0.0 112.779 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.432 HG22 ' HG3' ' A' ' 118' ' ' PRO . 72.4 t -61.41 -42.54 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.14 -16.33 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 111.074 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.28 28.8 15.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.548 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -115.6 145.28 42.83 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.915 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -52.71 149.24 6.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.447 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.71 103.19 5.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.812 -178.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -71.38 157.72 89.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.385 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -37.14 95.65 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 121.616 1.544 . . . . 0.0 110.785 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.18 0.7 55.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.209 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -67.33 -24.76 65.77 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 111.332 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.439 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 87.6 tt0 53.72 66.28 4.67 Favored Pre-proline 0 N--CA 1.438 -1.042 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.418 -177.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.9 Cg_exo -62.0 146.2 96.38 Favored 'Trans proline' 0 C--N 1.302 -1.887 0 C-N-CA 122.458 2.105 . . . . 0.0 111.906 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.436 ' CB ' HD22 ' A' ' 92' ' ' LEU . 95.9 mtt180 -138.82 142.67 38.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.541 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.6 tp -99.82 126.55 45.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.307 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.522 HD23 ' OE1' ' A' ' 123' ' ' GLN . 1.9 mp -83.45 165.59 39.46 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.884 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -64.74 -14.42 44.7 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 123.205 2.604 . . . . 0.0 112.502 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -92.15 1.04 57.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.15 46.72 0.09 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.04 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -131.11 119.32 21.77 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.487 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -87.1 132.53 33.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.995 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.616 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -147.25 162.37 39.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.4 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.7 m -59.52 147.56 36.41 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.27 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -60.42 -44.28 95.91 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.344 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.47 -40.63 97.28 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.901 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.9 m -67.64 -34.12 76.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.064 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.616 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -63.86 -36.99 85.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.155 -179.129 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.61 -59.99 7.34 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.327 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -64.0 -16.42 54.8 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.43 2.087 . . . . 0.0 112.139 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.34 -37.58 81.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.008 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.625 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.606 179.664 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.172 -1.171 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.5 t0 75.47 81.34 0.1 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.051 0.453 . . . . 0.0 111.459 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.75 -17.34 45.97 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.26 -123.18 0.29 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.1 m -62.05 148.08 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-O 121.416 0.627 . . . . 0.0 110.715 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 88.3 t -107.57 141.52 22.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.205 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.34 135.08 34.04 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.971 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 42.0 t -122.82 134.25 24.92 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.369 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.432 ' HG3' HG22 ' A' ' 67' ' ' VAL . 34.5 Cg_endo -64.91 -9.16 20.26 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 CA-C-N 120.431 1.19 . . . . 0.0 112.556 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 17.3 t -93.26 -61.27 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.326 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 29.1 p -99.51 -22.28 15.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.4 mptt 55.07 29.25 12.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.157 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -162.03 129.92 4.05 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.988 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.522 ' OE1' HD23 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -122.72 130.59 53.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.895 179.49 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 93.4 m -61.69 -47.7 84.1 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.772 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -145.2 176.8 9.26 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.465 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.423 ' HA ' HG23 ' A' ' 129' ' ' ILE . 0.1 OUTLIER -109.3 32.18 5.17 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.017 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -86.2 -31.17 21.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.628 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -103.86 22.49 14.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.884 0.373 . . . . 0.0 111.668 -179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.423 HG23 ' HA ' ' A' ' 126' ' ' SER . 41.3 pt -68.19 -169.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.775 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.424 HG13 HD23 ' A' ' 92' ' ' LEU . 2.2 m -36.49 104.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 O-C-N 124.045 0.84 . . . . 0.0 110.828 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 170.79 -32.75 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 124.027 0.829 . . . . 0.0 110.362 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -83.45 64.36 7.81 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.795 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -97.81 29.25 3.47 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.414 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.4 -48.01 83.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.628 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.7 tpt -77.31 119.83 21.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.23 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.8 mtm180 -123.8 35.82 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.035 0.445 . . . . 0.0 110.806 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.47 141.89 58.18 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.757 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.132 179.937 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.435 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 121.093 0.473 . . . . 0.0 110.387 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 49.7 mp0 -84.0 32.42 0.48 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.475 0.655 . . . . 0.0 110.823 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.664 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.87 -11.65 13.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.405 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.404 HD23 ' HG3' ' A' ' 63' ' ' GLU . 55.5 mt -48.36 -22.36 0.68 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.612 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -58.44 -42.37 87.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.068 0.461 . . . . 0.0 110.206 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.5 mt -104.31 -39.59 6.42 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.72 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.26 -84.1 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.664 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.1 mt-10 166.52 -80.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.978 0.799 . . . . 0.0 110.966 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.99 170.14 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.104 0.478 . . . . 0.0 110.157 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.461 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 23.8 t -87.59 141.87 28.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.335 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.29 -39.21 92.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.653 -0.308 . . . . 0.0 112.38 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 74.9 t -61.52 -37.91 78.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -24.67 10.89 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.177 0.513 . . . . 0.0 111.116 -178.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 65.43 33.0 9.17 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.836 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -128.81 149.08 50.89 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.78 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -52.6 147.94 7.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.904 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.456 HD13 ' HB3' ' A' ' 78' ' ' PRO . 73.6 mt -72.78 116.51 13.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.001 -178.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.95 161.8 72.32 Favored Pre-proline 0 N--CA 1.463 0.224 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.305 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.67 -40.26 74.95 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.083 1.856 . . . . 0.0 111.641 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -90.03 1.92 55.78 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.296 179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.29 -24.83 66.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.669 -178.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 52.48 70.56 1.82 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-O 121.351 0.596 . . . . 0.0 109.899 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.456 ' HB3' HD13 ' A' ' 72' ' ' LEU . 57.4 Cg_endo -70.11 153.57 67.18 Favored 'Trans proline' 0 C--N 1.294 -2.32 0 C-N-CA 122.843 2.362 . . . . 0.0 111.412 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.412 ' HD2' HG12 ' A' ' 130' ' ' VAL . 0.0 OUTLIER -148.6 174.62 11.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.506 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -126.06 141.07 52.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.986 0.422 . . . . 0.0 111.33 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.534 ' CD1' HD22 ' A' ' 92' ' ' LEU . 2.2 mp -101.17 165.6 13.88 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-O 121.136 0.493 . . . . 0.0 110.897 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.51 -16.45 54.69 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.318 2.679 . . . . 0.0 112.155 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 26.7 p -86.31 -6.09 59.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.317 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 78.14 48.01 0.05 OUTLIER 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.923 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -129.98 121.74 27.13 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.295 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.4 m -87.06 138.64 31.32 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.998 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.695 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -157.92 166.69 31.98 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.127 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.468 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.7 m -68.83 139.68 55.22 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 t -56.75 -42.84 80.02 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.298 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.38 -40.41 94.22 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 97.8 m -71.01 -22.14 62.2 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.235 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.695 HD21 ' HB3' ' A' ' 87' ' ' ALA . 84.3 mt -81.17 -20.72 40.63 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.525 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -59.84 -53.42 46.07 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 120.556 -0.831 . . . . 0.0 111.571 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.24 -19.31 33.85 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.641 2.227 . . . . 0.0 111.779 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.99 -38.19 78.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.447 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.992 -179.947 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.9 t0 69.22 76.75 0.23 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.08 -17.68 37.54 Favored Glycine 0 N--CA 1.452 -0.236 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 82.2 p -115.11 -120.92 0.3 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.568 -0.316 . . . . 0.0 110.17 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.29 142.83 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 121.017 0.437 . . . . 0.0 110.311 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.3 t -107.17 129.84 60.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.717 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -74.29 123.76 25.17 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.964 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 121' ' ' LYS . 23.4 t -106.76 129.65 24.09 Favored Pre-proline 0 C--O 1.199 -1.57 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.874 -179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -61.36 -10.22 15.28 Favored 'Trans proline' 0 C--N 1.295 -2.273 0 CA-C-N 121.715 1.648 . . . . 0.0 113.34 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.7 t -85.81 -43.73 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.394 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -120.21 -30.07 4.71 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.503 0.668 . . . . 0.0 110.307 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.9 OUTLIER 65.14 35.16 8.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.146 178.95 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -164.3 123.12 1.87 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.32 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.13 159.64 23.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.344 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.2 m -87.59 -55.85 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.58 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -143.52 176.82 8.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 16.0 p -101.82 27.2 6.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.022 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -88.52 -28.83 20.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.382 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -112.72 22.68 14.27 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.654 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.1 pt -86.04 -169.95 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.966 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.412 HG12 ' HD2' ' A' ' 79' ' ' ARG . 2.2 m -43.27 106.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 O-C-N 123.721 0.638 . . . . 0.0 110.248 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.64 -22.41 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 124.408 1.067 . . . . 0.0 110.864 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -97.56 22.62 8.69 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.983 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -41.2 139.29 1.0 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.416 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -161.52 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.088 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.08 144.02 50.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.947 0.403 . . . . 0.0 110.059 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -82.66 68.45 9.13 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.458 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.58 134.27 54.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.922 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 12.6 p . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.624 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.636 ' HB3' ' HE ' ' A' ' 71' ' ' ARG . . . . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -95.26 20.5 9.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.397 0.618 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.0 -12.32 18.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.63 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.416 HD23 ' HG3' ' A' ' 63' ' ' GLU . 36.6 mt -49.01 -23.67 1.24 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.165 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -59.68 -43.5 93.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.691 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 80' ' ' LEU . 57.5 mt -104.47 -41.56 5.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.599 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.74 -89.93 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.631 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 165.24 -79.03 0.0 OUTLIER 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.5 0.72 . . . . 0.0 110.836 179.569 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -99.87 167.22 10.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.117 0.484 . . . . 0.0 110.116 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 27.2 t -82.05 136.72 35.19 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.516 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -71.46 -30.07 67.26 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.72 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.1 t -61.53 -39.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.23 -17.39 11.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 0.0 111.22 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.75 38.43 9.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.791 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -129.3 144.9 51.4 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.043 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.636 ' HE ' ' HB3' ' A' ' 56' ' ' ALA . 42.4 ttt180 -50.71 148.89 3.64 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.426 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.4 HD13 ' HB3' ' A' ' 78' ' ' PRO . 80.0 mt -75.47 120.24 20.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.466 -178.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -82.76 163.03 53.4 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.204 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.08 -34.09 47.93 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 121.908 1.738 . . . . 0.0 111.579 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -92.68 -2.03 56.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.389 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -66.89 -23.88 66.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.233 0.54 . . . . 0.0 111.514 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 54.72 70.34 1.7 Allowed Pre-proline 0 N--CA 1.446 -0.636 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.877 -178.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.4 ' HB3' HD13 ' A' ' 72' ' ' LEU . 40.3 Cg_endo -67.49 149.26 80.04 Favored 'Trans proline' 0 C--N 1.3 -1.986 0 C-N-CA 123.148 2.565 . . . . 0.0 111.913 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -141.7 162.29 35.85 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.131 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 61' ' ' LEU . 57.6 tp -115.44 127.69 55.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.903 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.75 164.55 36.62 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.842 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 -6.42 19.04 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.92 2.413 . . . . 0.0 112.334 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.6 p -95.38 3.95 53.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 75.22 41.21 0.3 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.521 0.677 . . . . 0.0 111.346 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.495 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.3 m170 -134.55 119.75 18.82 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.732 178.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.9 m -86.64 139.63 30.61 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.911 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.648 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -149.95 166.86 28.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 -179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -68.2 151.84 46.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.697 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.4 t -60.35 -47.15 87.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.337 0.589 . . . . 0.0 110.22 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.34 -40.02 96.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.135 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.81 -27.1 64.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.998 0.427 . . . . 0.0 109.85 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.648 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -68.34 -37.87 80.94 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.824 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.12 -61.31 5.47 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.21 -29.51 76.02 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.961 2.441 . . . . 0.0 111.682 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.45 -40.5 91.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.172 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.143 179.211 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.466 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.1 t0 68.24 82.53 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.534 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.93 -14.69 40.9 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.74 -121.44 0.3 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.341 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 123' ' ' GLN . 3.2 m -62.78 143.54 15.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 122.078 -0.389 . . . . 0.0 110.482 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 98.7 t -119.34 131.06 73.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.985 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.41 ' O ' ' HB1' ' A' ' 95' ' ' ALA . 0.4 OUTLIER -69.89 141.76 53.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.204 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.482 ' H ' ' HA ' ' A' ' 121' ' ' LYS . 19.2 t -139.94 132.77 15.04 Favored Pre-proline 0 N--CA 1.444 -0.733 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.484 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.406 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 31.1 Cg_endo -63.06 -9.59 17.58 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 121.384 1.389 . . . . 0.0 112.798 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.495 HG11 ' NE2' ' A' ' 85' ' ' HIS . 6.5 t -94.56 -61.04 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.4 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 11.0 p -99.05 -27.13 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.782 0.325 . . . . 0.0 110.983 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.482 ' HA ' ' H ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER 57.5 31.7 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 179.336 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -168.25 136.69 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.451 ' O ' HG12 ' A' ' 114' ' ' VAL . 2.6 mm-40 -142.3 123.53 14.68 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.52 179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 91.8 m -61.79 -44.33 97.09 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -144.12 177.18 8.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.635 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.459 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -121.0 63.75 0.87 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.273 0.558 . . . . 0.0 111.582 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -89.14 -30.0 18.93 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.507 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.2 23.14 13.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 111.535 -178.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.459 HD13 ' HB2' ' A' ' 126' ' ' SER . 10.6 pt -64.69 -169.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.35 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.643 HG13 HD23 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -35.59 104.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 O-C-N 123.924 0.765 . . . . 0.0 110.578 -179.674 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 172.54 -34.2 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 124.135 0.897 . . . . 0.0 110.599 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -83.99 70.18 10.42 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.808 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -97.39 33.0 2.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.843 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -58.65 -48.24 81.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.9 mmt -70.1 143.68 52.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.73 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -160.43 31.06 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.39 0.614 . . . . 0.0 110.501 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -98.0 162.06 13.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.523 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 90.9 p . . . . . 0 N--CA 1.453 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -90.12 31.16 1.01 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.827 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.638 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -63.03 -12.34 25.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.443 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.458 HD23 ' HG3' ' A' ' 63' ' ' GLU . 38.6 mt -49.41 -23.16 1.38 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.989 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -59.24 -44.43 92.35 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.835 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.9 -41.78 5.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -162.81 -87.55 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.638 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 168.36 -80.06 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.765 0.666 . . . . 0.0 111.269 179.788 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -113.79 164.05 14.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.163 0.506 . . . . 0.0 110.149 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.451 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 13.6 t -79.41 138.58 37.68 Favored 'General case' 0 C--O 1.211 -0.929 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.851 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.67 -35.82 81.45 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.741 -0.266 . . . . 0.0 112.747 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.2 t -59.09 -43.8 90.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 9.9 p -109.5 -18.43 13.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.837 0.351 . . . . 0.0 111.587 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 64.93 30.19 12.05 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.933 178.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -119.7 148.58 43.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.282 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -54.27 150.83 8.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.626 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 78' ' ' PRO . 57.7 mt -80.48 105.54 11.81 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.696 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.445 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 2.9 ptm180 -80.83 167.13 34.68 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.165 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -52.29 -46.83 30.29 Favored 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 122.607 2.204 . . . . 0.0 113.033 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.7 mt-10 -82.8 0.07 45.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.204 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.21 -24.46 64.94 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 47.14 73.09 1.06 Allowed Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.283 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.494 ' HB3' HD13 ' A' ' 72' ' ' LEU . 46.9 Cg_endo -68.36 147.9 72.69 Favored 'Trans proline' 0 C--N 1.299 -2.063 0 C-N-CA 122.711 2.274 . . . . 0.0 112.008 -179.05 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.85 156.08 45.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.792 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.4 tp -106.88 127.33 53.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.27 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.575 HD11 HD22 ' A' ' 92' ' ' LEU . 2.5 mp -86.39 167.06 24.8 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.023 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.69 -20.32 64.86 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.984 2.456 . . . . 0.0 112.224 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 7.2 p -89.64 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.63 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 73.02 50.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.994 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.509 ' CE1' HG11 ' A' ' 119' ' ' VAL . 51.9 m170 -128.97 124.4 34.92 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.868 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -85.79 132.89 34.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.767 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -151.16 165.54 33.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.043 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.437 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -71.11 136.75 48.36 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.822 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.8 t -53.95 -43.29 69.74 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.031 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.28 -39.16 89.39 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.3 m -68.09 -33.65 74.93 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.241 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.767 HD21 ' HB3' ' A' ' 87' ' ' ALA . 84.9 mt -67.19 -28.76 68.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.178 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.402 ' N ' ' HD2' ' A' ' 94' ' ' PRO . . . -53.57 -60.51 8.16 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.392 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 93' ' ' GLY . 30.8 Cg_endo -64.56 -10.34 24.02 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.633 2.222 . . . . 0.0 112.624 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.51 -30.17 66.85 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.789 0.328 . . . . 0.0 110.219 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.437 ' HB2' HG13 ' A' ' 115' ' ' VAL . . . . . . . . 0 CA--C 1.534 0.334 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.449 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.511 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.1 t0 61.16 76.69 0.36 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.831 0.348 . . . . 0.0 110.915 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.77 -17.52 35.76 Favored Glycine 0 CA--C 1.519 0.298 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 77.3 p -115.83 -120.6 0.3 Allowed 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 123' ' ' GLN . 78.4 t -65.0 137.2 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 CA-C-O 120.964 0.411 . . . . 0.0 110.525 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.533 HG21 HG21 ' A' ' 129' ' ' ILE . 96.8 t -106.48 142.41 19.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.408 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -84.87 114.73 22.32 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.478 0.656 . . . . 0.0 111.009 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.4 t -104.56 132.97 20.44 Favored Pre-proline 0 C--O 1.206 -1.229 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.216 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.11 -16.3 26.72 Favored 'Trans proline' 0 C--N 1.297 -2.15 0 C-N-CA 121.216 1.278 . . . . 0.0 112.626 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.509 HG11 ' CE1' ' A' ' 85' ' ' HIS . 16.4 t -96.39 -51.72 10.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.35 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -31.7 11.67 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.953 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 117' ' ' CYS . 3.0 mptt 59.46 22.82 11.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.12 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -172.8 97.86 0.13 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.233 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.588 ' O ' HG13 ' A' ' 114' ' ' VAL . 28.6 mm100 -89.52 145.81 25.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 0.0 110.374 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 88.5 m -61.03 -46.52 90.41 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.498 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -145.93 178.0 8.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.918 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.543 ' HA ' HG23 ' A' ' 129' ' ' ILE . 1.2 p -116.28 36.85 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.48 0.657 . . . . 0.0 111.64 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -89.65 -31.22 17.62 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.623 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -108.86 20.75 18.1 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.656 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.543 HG23 ' HA ' ' A' ' 126' ' ' SER . 24.2 pt -71.25 -169.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.524 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.441 HG22 ' O ' ' A' ' 130' ' ' VAL . 0.2 OUTLIER -37.68 108.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 O-C-N 123.8 0.688 . . . . 0.0 110.12 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 164.74 -31.57 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 124.818 1.324 . . . . 0.0 111.321 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -93.47 85.87 5.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.958 -0.697 . . . . 0.0 111.29 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -93.19 137.38 32.57 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.909 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -94.85 -75.78 0.51 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.815 0.34 . . . . 0.0 110.51 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 28.1 ttt -146.02 142.54 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -83.93 64.98 8.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.355 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.64 122.34 13.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.173 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.792 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.78 0.324 . . . . 0.0 110.602 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -90.8 28.81 1.45 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.724 0.774 . . . . 0.0 110.681 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.659 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.55 -11.99 19.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.409 HD23 ' HG3' ' A' ' 63' ' ' GLU . 36.5 mt -48.58 -23.59 1.05 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.277 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.97 -43.35 91.32 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.0 110.594 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.442 HD11 ' CG ' ' A' ' 134' ' ' PHE . 69.9 mt -104.6 -41.06 5.8 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.022 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.23 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.659 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 165.45 -78.13 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.117 0 O-C-N 123.953 0.783 . . . . 0.0 110.75 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.5 p-80 -107.88 165.98 11.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 110.824 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.543 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 13.3 t -81.12 137.14 35.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.563 -179.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.81 -37.98 93.92 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.676 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.488 HG22 ' HG3' ' A' ' 118' ' ' PRO . 73.1 t -59.93 -40.81 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 8.4 p -112.64 -18.63 12.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.943 0.401 . . . . 0.0 111.109 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.32 39.62 9.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.309 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.49 146.79 50.71 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.216 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -55.99 144.42 28.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.633 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.521 HD13 ' HB3' ' A' ' 78' ' ' PRO . 80.7 mt -71.19 105.85 3.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.447 -179.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.463 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 3.5 ptm180 -79.93 165.8 44.84 Favored Pre-proline 0 C--N 1.333 -0.133 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.554 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -53.05 -43.53 56.24 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 122.432 2.088 . . . . 0.0 113.31 -177.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.463 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.2 mt-10 -88.15 2.26 52.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -66.01 -24.98 66.87 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.983 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 50.56 69.0 2.87 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 109.791 -179.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.521 ' HB3' HD13 ' A' ' 72' ' ' LEU . 51.2 Cg_endo -68.9 150.81 73.72 Favored 'Trans proline' 0 C--N 1.293 -2.386 0 C-N-CA 122.628 2.219 . . . . 0.0 111.078 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.32 165.49 29.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.673 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp -114.35 130.19 56.67 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.914 0.388 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.516 HD11 HD22 ' A' ' 92' ' ' LEU . 3.7 mp -90.16 164.54 27.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.242 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.51 -6.2 18.6 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.043 2.495 . . . . 0.0 112.33 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.77 0.91 55.33 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.376 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 77.65 41.54 0.13 Allowed 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 123.825 0.703 . . . . 0.0 111.338 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.463 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.4 m170 -135.29 119.85 18.14 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.995 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -86.52 141.64 28.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.9 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.787 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -157.63 166.86 31.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.875 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' CYS . . . . . 0.47 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -65.77 137.05 56.99 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.9 t -56.72 -42.19 78.76 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.069 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.27 91.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 80.8 m -66.83 -36.25 81.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.204 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.787 HD21 ' HB3' ' A' ' 87' ' ' ALA . 82.0 mt -66.09 -30.55 71.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.27 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.95 -62.35 4.65 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.866 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.38 -17.29 59.37 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.131 1.887 . . . . 0.0 112.05 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.01 -37.28 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.328 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.152 179.603 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.427 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.6 t0 73.03 81.65 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.783 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.31 -17.4 40.48 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 75.6 p -115.7 -122.16 0.29 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.9 m -63.3 142.91 16.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.807 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.535 HG23 ' OG ' ' A' ' 126' ' ' SER . 56.4 t -113.63 140.72 32.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.421 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -87.74 129.25 35.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.537 0.684 . . . . 0.0 109.913 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.0 t -116.12 131.41 23.78 Favored Pre-proline 0 C--O 1.195 -1.765 0 CA-C-N 114.805 -1.088 . . . . 0.0 108.226 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.488 ' HG3' HG22 ' A' ' 67' ' ' VAL . 23.9 Cg_endo -59.6 -11.5 14.44 Favored 'Trans proline' 0 C--N 1.295 -2.25 0 CA-C-N 121.502 1.572 . . . . 0.0 113.176 -178.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.463 HG11 ' NE2' ' A' ' 85' ' ' HIS . 21.4 t -84.01 -44.82 18.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.541 -0.463 . . . . 0.0 111.7 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.55 -30.69 5.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.02 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.2 OUTLIER 64.24 31.44 13.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.073 178.581 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -162.72 139.43 7.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.996 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -143.05 161.49 38.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.077 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 80.4 m -96.48 -43.16 7.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.998 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -142.34 175.05 10.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.251 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.535 ' OG ' HG23 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -125.06 42.71 3.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.336 0.588 . . . . 0.0 111.217 179.6 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -85.75 -15.45 42.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.031 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -114.33 22.48 13.69 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.6 pt -69.12 -173.65 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.774 0.321 . . . . 0.0 111.144 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.462 HG12 HD12 ' A' ' 92' ' ' LEU . 2.3 m -45.47 105.61 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.284 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.572 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 168.26 -32.16 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 124.152 0.908 . . . . 0.0 110.576 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -93.31 64.95 3.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.154 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -60.83 139.37 57.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.394 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' PHE . . . . . 0.442 ' CG ' HD11 ' A' ' 61' ' ' LEU . 80.7 t80 -93.56 -72.95 0.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.485 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.7 ttt -150.79 144.86 25.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.596 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -122.48 99.69 6.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -135.75 34.6 2.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.696 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 15.5 m . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.1 mp0 -94.41 30.26 2.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.77 0.795 . . . . 0.0 110.148 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.8 -11.98 15.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.447 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.425 HD23 ' HG3' ' A' ' 63' ' ' GLU . 43.8 mt -47.51 -24.07 0.77 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.309 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -58.98 -41.74 88.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.331 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 mp -104.42 -40.91 5.9 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.934 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.55 -85.49 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 164.7 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 O-C-N 124.136 0.898 . . . . 0.0 110.905 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.88 162.37 14.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.306 0.574 . . . . 0.0 110.699 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 30.5 t -73.31 134.9 44.31 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.544 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.5 -30.07 71.28 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.775 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.1 t -64.11 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.06 -15.47 11.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 110.972 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.33 41.09 8.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.254 0.55 . . . . 0.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -126.19 144.97 50.57 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.196 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -52.57 151.98 3.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.64 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.3 mt -85.87 102.28 13.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.017 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -75.9 160.22 79.14 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.854 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -57.59 -33.16 96.15 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.161 1.907 . . . . 0.0 111.319 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -89.03 -8.17 54.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.449 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -67.78 -24.33 65.31 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.911 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 51.09 73.6 0.95 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.479 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.04 149.43 71.49 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.706 2.27 . . . . 0.0 111.739 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.423 ' CZ ' HG23 ' A' ' 130' ' ' VAL . 96.0 mtt180 -141.54 141.58 33.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.306 -178.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.8 tp -92.65 129.22 38.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.47 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -85.59 165.37 35.81 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.27 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -62.68 -18.33 63.5 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.175 2.583 . . . . 0.0 112.34 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.64 2.7 55.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.103 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.7 47.68 0.12 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.206 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -133.91 124.75 26.94 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.472 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.9 m -85.06 138.49 32.4 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.987 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.594 ' HB3' HD12 ' A' ' 92' ' ' LEU . . . -147.98 160.88 42.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.314 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 6.3 m -62.67 151.83 37.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.5 t -58.74 -47.56 84.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.985 0.422 . . . . 0.0 110.582 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.79 -42.44 95.05 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.817 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.8 m -67.07 -23.72 65.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.204 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.594 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -64.56 -32.11 73.62 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.126 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.49 -65.14 3.44 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 95' ' ' ALA . 22.0 Cg_exo -64.37 110.5 1.4 Allowed 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.689 2.26 . . . . 0.0 111.492 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.669 ' HB1' ' O ' ' A' ' 116' ' ' ASP . . . 169.56 -71.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.629 0.581 . . . . 0.0 110.057 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.742 ' HB2' HG22 ' A' ' 115' ' ' VAL . . . . . . . . 0 CA--C 1.54 0.559 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.919 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.501 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.37 73.55 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.026 0.441 . . . . 0.0 110.628 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 102.98 -13.44 56.06 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.0 p -114.68 -118.94 0.31 Allowed 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.428 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.7 m -61.3 141.83 16.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.742 HG22 ' HB2' ' A' ' 96' ' ' ALA . 58.5 t -107.74 134.01 50.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.117 -178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.669 ' O ' ' HB1' ' A' ' 95' ' ' ALA . 15.8 t70 -81.37 108.66 15.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.968 0.889 . . . . 0.0 110.54 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 121' ' ' LYS . 36.6 t -95.83 131.76 28.55 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.787 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.97 -12.07 14.21 Favored 'Trans proline' 0 C--N 1.297 -2.147 0 C-N-CA 121.003 1.136 . . . . 0.0 112.771 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.44 -61.58 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.504 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 9.3 p -98.7 -25.35 14.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.953 0.406 . . . . 0.0 110.85 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.7 mptt 55.74 32.66 19.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -165.27 137.47 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.03 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -144.6 142.08 29.9 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 98.7 m -70.86 -44.63 66.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.011 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -145.49 178.07 8.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.711 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.54 48.86 1.52 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.481 0.658 . . . . 0.0 111.516 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.01 -29.7 21.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.282 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -103.86 20.49 18.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.904 0.383 . . . . 0.0 111.392 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.6 pt -62.9 -168.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.483 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -35.31 116.5 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 O-C-N 124.054 0.846 . . . . 0.0 110.437 -179.756 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 161.63 -32.52 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.465 0 O-C-N 124.986 1.429 . . . . 0.0 110.013 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -85.59 60.02 5.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.228 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -97.25 28.59 3.56 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.473 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -59.48 -48.04 83.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.6 mmt -78.83 121.1 24.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.237 0.541 . . . . 0.0 110.844 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -153.35 104.34 2.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.22 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -108.4 -80.93 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.133 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 18.6 p . . . . . 0 C--N 1.333 -0.117 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.339 179.634 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.065 0.46 . . . . 0.0 109.799 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.96 19.82 1.31 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.093 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.652 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -59.81 -12.67 7.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.632 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.414 HD23 ' HG3' ' A' ' 63' ' ' GLU . 44.3 mt -47.93 -24.02 0.93 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.461 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -59.39 -41.58 89.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.067 0.46 . . . . 0.0 110.382 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -104.0 -40.43 6.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.869 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.35 -86.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.652 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.5 mt-10 164.29 -78.95 0.0 OUTLIER 'General case' 0 CA--C 1.527 0.064 0 O-C-N 124.037 0.835 . . . . 0.0 110.823 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -106.17 163.09 13.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.315 0.579 . . . . 0.0 110.72 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -76.73 135.1 39.02 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.216 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.86 -37.94 94.93 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.634 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.494 HG22 ' HG2' ' A' ' 118' ' ' PRO . 78.2 t -60.41 -40.32 83.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -176.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 7.7 p -113.07 -17.79 12.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.956 0.408 . . . . 0.0 110.939 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.23 41.31 8.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.368 179.09 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -129.76 147.8 51.57 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.161 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.8 tpp85 -54.26 144.74 19.39 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.941 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.9 mt -75.53 102.85 5.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.24 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -78.83 164.28 56.13 Favored Pre-proline 0 C--N 1.331 -0.207 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.86 -48.28 17.23 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 C-N-CA 121.44 1.427 . . . . 0.0 112.668 -178.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -72.2 -4.87 31.89 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.968 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -67.34 -25.14 65.85 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.777 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 51.78 72.11 1.3 Allowed Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.255 -178.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.81 148.2 76.57 Favored 'Trans proline' 0 C--N 1.297 -2.157 0 C-N-CA 122.711 2.274 . . . . 0.0 112.102 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -139.52 160.89 38.8 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.161 -178.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.2 tp -115.31 127.85 55.71 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.013 0.435 . . . . 0.0 111.019 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.3 mp -87.39 164.59 34.75 Favored Pre-proline 0 N--CA 1.467 0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.097 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.57 -6.67 19.63 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 123.061 2.508 . . . . 0.0 112.408 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -94.5 0.1 55.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 78.33 41.67 0.11 Allowed 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.947 0.779 . . . . 0.0 111.221 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.465 ' CD2' HG11 ' A' ' 119' ' ' VAL . 33.8 m170 -134.79 123.94 24.36 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.515 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.5 m -86.83 143.49 27.45 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.828 -0.749 . . . . 0.0 109.719 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.64 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -150.49 164.48 35.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.992 -179.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 21.1 m -66.85 151.08 48.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.181 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.3 p -61.8 -42.24 98.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.616 0.722 . . . . 0.0 109.878 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.46 95.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.268 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.92 -31.85 69.83 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.775 0.798 . . . . 0.0 109.963 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.64 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -63.46 -37.14 86.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.429 -179.724 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.64 -62.31 4.94 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 120.508 -0.853 . . . . 0.0 111.203 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.21 -22.6 66.89 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 122.08 1.854 . . . . 0.0 111.467 179.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.65 -38.9 82.67 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.934 179.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.473 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.962 178.969 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.605 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.6 t0 74.57 83.24 0.11 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.895 0.409 . . . . 0.0 111.957 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.3 -9.44 45.78 Favored Glycine 0 CA--C 1.519 0.294 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.1 t -116.69 -118.57 0.32 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.33 151.53 4.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.358 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.7 t -112.71 135.36 52.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.099 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -77.62 104.22 8.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.55 0.69 . . . . 0.0 109.553 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 121' ' ' LYS . 13.1 t -100.13 116.99 64.02 Favored Pre-proline 0 C--O 1.204 -1.296 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.637 -179.228 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.494 ' HG2' HG22 ' A' ' 67' ' ' VAL . 38.6 Cg_exo -53.2 -16.06 6.24 Favored 'Trans proline' 0 C--N 1.297 -2.142 0 CA-C-N 121.068 1.417 . . . . 0.0 113.47 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.465 HG11 ' CD2' ' A' ' 85' ' ' HIS . 23.3 t -79.03 -62.11 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.742 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.8 p -99.73 -29.13 12.82 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.463 0.649 . . . . 0.0 109.826 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.429 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.4 OUTLIER 63.94 33.1 12.69 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.22 178.78 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -164.63 138.6 5.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.998 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -145.4 165.57 28.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.993 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.3 m -95.92 -50.99 4.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.357 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -142.45 176.24 9.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.736 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.37 34.48 4.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.428 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.5 ptmt -77.18 -22.53 52.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.21 22.3 14.91 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.448 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 45.5 pt -65.98 -168.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -36.39 115.32 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 O-C-N 124.066 0.854 . . . . 0.0 110.666 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 164.19 -31.76 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 124.914 1.384 . . . . 0.0 109.871 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -86.14 60.19 6.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.934 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -91.31 36.96 0.93 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.712 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.87 -48.4 81.52 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.235 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.0 mmt -84.49 139.32 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.071 0.462 . . . . 0.0 111.029 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -148.35 48.58 1.04 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.508 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.07 159.28 15.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.534 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.3 p . . . . . 0 C--N 1.33 -0.272 0 CA-C-O 120.821 0.344 . . . . 0.0 110.949 -179.623 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.597 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 155.06 -164.99 32.08 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.2 140.33 41.67 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -89.39 37.42 0.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 110.504 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.63 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -63.44 -12.32 30.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.773 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.466 HD23 ' HG3' ' A' ' 63' ' ' GLU . 37.5 mt -49.66 -23.11 1.56 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.125 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -59.46 -44.26 93.03 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.872 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 71.5 mt -104.74 -41.28 5.7 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.621 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.56 -88.04 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.63 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 167.33 -78.92 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.081 0 O-C-N 123.706 0.629 . . . . 0.0 110.92 179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -114.12 167.02 11.04 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.243 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.437 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.5 t -78.24 135.29 37.55 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.49 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.06 -38.71 94.29 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 121.564 -0.35 . . . . 0.0 113.068 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.08 -43.35 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.2 p -107.11 -18.74 13.81 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.865 0.364 . . . . 0.0 111.605 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.47 40.28 8.42 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.294 0.568 . . . . 0.0 110.491 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -130.84 146.77 52.37 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.175 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -52.17 149.23 5.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.601 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.44 HD23 ' HG2' ' A' ' 76' ' ' ARG . 73.6 mt -79.57 105.83 11.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.714 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -85.39 167.25 26.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.94 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.69 -51.57 10.82 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.476 1.451 . . . . 0.0 112.625 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.25 -5.03 33.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.522 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.44 ' HG2' HD23 ' A' ' 72' ' ' LEU . 1.6 tpm_? -66.67 -26.12 66.89 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.838 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 46.71 70.06 2.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 O-C-N 123.584 0.553 . . . . 0.0 109.614 -178.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.423 ' HB3' HD13 ' A' ' 72' ' ' LEU . 36.3 Cg_endo -66.18 145.06 77.47 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.923 2.415 . . . . 0.0 111.697 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -141.93 143.72 33.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.37 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.94 123.51 45.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.839 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.486 HD11 HD22 ' A' ' 92' ' ' LEU . 6.5 mp -83.55 168.19 23.81 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.605 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.471 ' CD ' HD12 ' A' ' 129' ' ' ILE . 11.8 Cg_exo -68.17 -14.57 40.96 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 123.154 2.569 . . . . 0.0 112.28 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.2 p -88.48 -0.77 57.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.237 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 75.52 46.37 0.11 Allowed 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 123.832 0.708 . . . . 0.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -134.12 117.53 16.68 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.881 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.0 m -87.59 141.45 28.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.096 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.7 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -156.88 164.59 37.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.805 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.456 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -62.95 137.22 58.21 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.556 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -56.38 -43.18 79.0 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.042 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.1 92.51 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.471 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.2 m -67.26 -33.56 75.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.29 0.567 . . . . 0.0 110.308 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.7 HD21 ' HB3' ' A' ' 87' ' ' ALA . 90.4 mt -68.81 -28.64 66.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.64 -62.3 6.36 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.562 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.27 -19.35 42.06 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 123.071 2.514 . . . . 0.0 111.758 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.12 -37.63 77.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.577 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.66 144.12 51.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.455 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.96 156.43 38.79 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 122.349 2.033 . . . . 0.0 112.422 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.56 134.73 37.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.434 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 47.5 30.78 1.74 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.636 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -152.4 156.0 38.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.712 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -152.72 168.15 26.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.1 t -159.0 145.75 17.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.618 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 64.6 m 51.57 44.14 29.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.79 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -99.67 117.79 5.98 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -62.56 -39.57 94.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.822 0.344 . . . . 0.0 110.615 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.25 163.65 33.0 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.04 -130.23 50.71 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -128.64 141.82 51.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.755 0.312 . . . . 0.0 110.393 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.77 136.89 52.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.792 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 89.26 168.45 43.64 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.8 t0 68.68 82.93 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.788 0.328 . . . . 0.0 110.721 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.39 -17.1 37.4 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -116.16 -119.33 0.31 Allowed 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.418 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.4 m -63.17 152.72 7.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.962 0.41 . . . . 0.0 110.096 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.703 ' HB ' HD11 ' A' ' 129' ' ' ILE . 82.8 t -127.98 142.06 44.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.745 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -80.52 125.41 29.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.636 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.7 135.47 19.77 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.331 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.68 -11.14 10.84 Favored 'Trans proline' 0 C--N 1.303 -1.868 0 CA-C-N 120.613 1.255 . . . . 0.0 112.939 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 22.3 t -94.35 -60.86 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.574 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.8 p -98.42 -26.37 14.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.975 0.416 . . . . 0.0 110.543 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mptt 57.64 35.24 25.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.978 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.66 144.81 4.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.918 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.04 153.68 40.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.659 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 92.7 m -95.69 -44.55 7.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.181 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -142.47 160.12 40.9 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.31 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.88 27.02 7.42 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.577 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -61.55 -41.46 97.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.452 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -105.32 16.37 25.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.327 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.703 HD11 ' HB ' ' A' ' 115' ' ' VAL . 0.2 OUTLIER -77.57 -176.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.133 -179.467 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.524 ' CG1' HD13 ' A' ' 92' ' ' LEU . 2.6 m -38.76 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.956 0.785 . . . . 0.0 109.762 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 161.97 -21.31 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.894 1.371 . . . . 0.0 111.244 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -106.89 30.46 6.11 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.978 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -42.43 118.42 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.321 0.581 . . . . 0.0 111.314 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -63.45 -51.92 63.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 171.03 -168.53 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.395 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -115.82 92.46 3.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.878 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.34 -10.01 55.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.007 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.9 p -64.64 156.88 28.7 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.782 0.325 . . . . 0.0 110.4 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -176.03 142.73 6.18 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 67.1 m 49.12 40.72 18.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.742 0.306 . . . . 0.0 110.564 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -93.48 124.2 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.17 148.36 27.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.0 -40.37 95.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 70.5 p -78.38 164.04 25.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.576 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.691 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.84 -39.92 98.13 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.99 140.31 57.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.751 0.31 . . . . 0.0 110.297 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -90.23 20.3 4.48 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.403 0.62 . . . . 0.0 111.172 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.635 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.52 -12.2 14.21 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.672 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.444 HD23 ' HG3' ' A' ' 63' ' ' GLU . 47.5 mt -49.61 -23.4 1.67 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.281 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -59.66 -42.28 92.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.014 0.435 . . . . 0.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.96 -40.14 6.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.718 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -85.53 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.635 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 167.1 -80.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 O-C-N 123.98 0.8 . . . . 0.0 110.649 179.087 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -109.24 164.67 12.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.55 0.69 . . . . 0.0 110.714 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.501 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 24.1 t -80.22 136.27 36.43 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.092 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.06 -35.6 89.34 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.399 -0.364 . . . . 0.0 112.727 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.75 -39.35 79.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -177.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.4 p -116.59 -17.43 10.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.487 . . . . 0.0 111.409 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.98 40.23 7.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.586 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.99 147.21 50.49 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.161 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -54.26 149.36 9.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.64 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 78' ' ' PRO . 78.2 mt -79.73 109.46 14.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.92 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -73.51 161.41 79.09 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.451 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -57.79 -40.25 80.52 Favored 'Trans proline' 0 N--CA 1.495 1.571 0 C-N-CA 122.261 1.974 . . . . 0.0 111.742 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -89.68 1.25 56.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.223 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.16 -24.8 65.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.943 0.401 . . . . 0.0 111.681 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 54.3 71.76 1.27 Allowed Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.137 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HB3' HD13 ' A' ' 72' ' ' LEU . 60.0 Cg_endo -72.0 152.26 57.03 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 C-N-CA 122.752 2.302 . . . . 0.0 111.085 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.443 ' HD2' HG12 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -139.75 166.95 23.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.307 -179.559 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 tp -118.43 126.78 52.79 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.44 HD11 HD22 ' A' ' 92' ' ' LEU . 3.8 mp -85.67 168.53 19.35 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -67.08 -15.71 47.31 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 123.332 2.688 . . . . 0.0 112.538 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 11.2 p -93.44 1.12 56.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.4 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.02 51.51 0.11 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.38 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.422 ' CE1' HG11 ' A' ' 119' ' ' VAL . 56.2 m170 -128.07 121.46 29.73 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.51 178.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -87.6 132.37 34.09 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.235 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.695 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -150.22 162.04 41.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.803 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -66.51 136.55 55.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -56.57 -42.06 77.96 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.573 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.96 91.59 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.1 m -68.19 -32.99 73.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.239 0.542 . . . . 0.0 110.009 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.695 HD21 ' HB3' ' A' ' 87' ' ' ALA . 93.7 mt -70.78 -26.67 63.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.849 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.66 -60.0 9.78 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.8 -0.715 . . . . 0.0 111.751 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.31 -16.36 34.15 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.95 2.434 . . . . 0.0 111.993 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.3 -38.47 80.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.679 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.88 146.29 99.0 Favored Pre-proline 0 CA--C 1.535 0.385 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.216 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.31 -21.37 31.03 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.47 2.113 . . . . 0.0 112.664 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' ' 99' ' ' ALA . . . 59.36 35.1 23.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.519 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 98' ' ' ALA . . . 67.54 31.55 6.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.683 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -119.31 7.88 11.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.013 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -150.64 125.06 9.52 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.224 0.535 . . . . 0.0 111.155 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 82.2 p -72.13 163.49 27.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.429 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.8 t -109.25 122.53 47.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.869 0.366 . . . . 0.0 110.482 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -66.82 131.02 31.09 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 51.59 28.61 4.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.764 0.316 . . . . 0.0 110.378 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -112.4 -169.85 18.06 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 108' ' ' ALA . . . -60.93 -41.16 99.22 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 107' ' ' GLY . . . 176.2 -56.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.925 0.393 . . . . 0.0 110.724 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.58 162.28 40.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.51 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -77.74 -145.0 2.27 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.5 t0 77.38 87.23 0.08 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.018 0.437 . . . . 0.0 111.37 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.36 -18.09 39.24 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.6 t -116.81 -122.84 0.29 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.45 149.38 9.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.113 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.462 ' HB ' HD11 ' A' ' 129' ' ' ILE . 59.4 t -123.49 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.729 -179.031 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -67.37 92.01 0.28 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.661 0.743 . . . . 0.0 109.688 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 9.1 t -75.33 132.79 75.48 Favored Pre-proline 0 C--O 1.212 -0.89 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.845 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.98 -14.13 35.4 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 120.803 1.322 . . . . 0.0 112.531 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.422 HG11 ' CE1' ' A' ' 85' ' ' HIS . 6.6 t -94.75 -50.37 11.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.296 -0.562 . . . . 0.0 112.414 -178.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.57 -29.27 10.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.377 0.608 . . . . 0.0 110.095 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 57.48 29.51 17.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.828 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -170.31 100.76 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.523 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -100.47 143.48 30.61 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.175 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.43 -54.29 25.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.564 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -145.18 171.69 14.17 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.121 0.486 . . . . 0.0 110.798 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.565 ' O ' HG22 ' A' ' 129' ' ' ILE . 13.7 p -93.57 8.78 39.44 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.552 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.87 -40.95 97.74 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.474 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -101.17 9.86 41.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.627 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.565 HG22 ' O ' ' A' ' 126' ' ' SER . 0.4 OUTLIER -86.15 -172.1 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.655 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.541 ' CG1' HD13 ' A' ' 92' ' ' LEU . 2.6 m -39.32 104.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 O-C-N 123.504 0.503 . . . . 0.0 110.983 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 162.86 -25.02 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 125.022 1.451 . . . . 0.0 110.56 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -104.6 57.55 0.7 Allowed 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.43 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 6.4 p90 -52.38 141.37 19.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.302 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -102.18 -74.97 0.61 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.368 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.1 ttt -151.26 144.43 24.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.726 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -83.92 62.63 7.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.837 0.351 . . . . 0.0 110.182 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -61.5 139.8 58.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.157 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 6.0 p 176.72 -26.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 124.49 -49.91 0.88 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 72.1 m -63.49 -39.97 95.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.183 0.516 . . . . 0.0 110.253 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -101.58 125.82 48.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.711 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.63 150.97 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.429 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -64.53 137.43 57.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 67.4 p -71.42 -26.31 62.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.708 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.681 -179.788 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.599 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.3 -41.81 99.73 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.031 -0.827 . . . . 0.0 111.031 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.91 130.67 35.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.832 0.349 . . . . 0.0 110.19 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -89.33 21.34 3.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.253 0.549 . . . . 0.0 110.947 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.622 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.12 -12.23 18.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.674 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.407 HD23 ' HG3' ' A' ' 63' ' ' GLU . 31.5 mt -49.73 -22.31 1.35 Allowed 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.222 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.02 -44.45 91.73 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.822 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 mt -104.81 -41.47 5.63 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.513 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.34 -89.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.622 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.2 mt-10 165.41 -79.99 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.107 0 O-C-N 123.879 0.737 . . . . 0.0 110.799 179.445 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -106.42 165.74 11.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.181 0.515 . . . . 0.0 110.319 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.441 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 18.9 t -80.02 137.03 36.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.764 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.08 -34.99 82.8 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 121.658 -0.306 . . . . 0.0 112.796 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.99 -42.32 89.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.1 p -111.25 -18.6 12.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.975 0.417 . . . . 0.0 111.234 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 64.17 38.56 8.16 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -128.03 144.32 51.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.207 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 149.37 2.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.395 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.0 mt -78.97 106.9 11.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.641 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.05 157.98 86.28 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.52 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.82 -38.45 95.8 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 121.985 1.79 . . . . 0.0 111.369 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -87.92 -0.59 57.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.308 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.55 -24.67 65.55 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 120.742 0.306 . . . . 0.0 111.703 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 56.56 70.02 1.58 Allowed Pre-proline 0 N--CA 1.442 -0.842 0 CA-C-O 121.405 0.621 . . . . 0.0 109.943 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.91 147.6 74.8 Favored 'Trans proline' 0 C--N 1.301 -1.948 0 C-N-CA 123.052 2.501 . . . . 0.0 111.485 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 mtm-85 -138.02 161.24 37.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.587 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.5 tp -116.97 124.77 50.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.037 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.565 HD11 HD22 ' A' ' 92' ' ' LEU . 5.2 mp -87.99 162.8 39.89 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.414 179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.74 -8.9 24.79 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 123.066 2.511 . . . . 0.0 112.419 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 22.1 p -92.44 2.42 56.68 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.067 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 73.9 41.68 0.4 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.488 0.661 . . . . 0.0 110.989 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -133.32 118.79 18.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.4 m -86.89 139.06 31.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.09 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.704 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -151.66 165.19 35.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.848 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.431 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -70.88 139.35 50.77 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -54.65 -43.41 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.237 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -40.08 92.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.6 m -67.78 -34.73 77.36 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.49 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.704 HD21 ' HB3' ' A' ' 87' ' ' ALA . 82.1 mt -64.93 -31.46 72.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.974 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.7 -63.07 4.4 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.469 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.25 -15.2 46.72 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 122.484 2.122 . . . . 0.0 112.321 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.51 -36.3 75.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.519 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.22 123.0 87.86 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.323 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.52 155.82 58.95 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.072 1.848 . . . . 0.0 112.454 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -144.89 155.53 43.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 133.24 55.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 0.0 110.525 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.46 -40.32 96.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.791 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -113.38 151.67 30.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.649 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 48.2 t -60.49 -42.6 96.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.428 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 82.7 p -69.85 161.29 30.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.642 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -89.78 12.36 67.51 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -60.28 -39.53 87.2 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.677 0.275 . . . . 0.0 110.707 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -96.82 146.24 18.2 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.85 163.2 54.89 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.66 154.05 39.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.846 0.355 . . . . 0.0 110.586 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -115.97 145.35 43.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.529 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 60.24 -129.26 47.38 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 t0 70.87 74.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.848 0.356 . . . . 0.0 110.937 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.17 -17.43 37.61 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -178.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 66.7 p -115.44 -119.31 0.31 Allowed 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.484 0.183 . . . . 0.0 110.513 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.432 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.3 m -59.13 141.97 15.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.214 0.531 . . . . 0.0 110.516 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.9 139.62 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.591 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -84.58 108.18 17.2 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.331 0.586 . . . . 0.0 110.281 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.404 ' HB3' ' SG ' ' A' ' 120' ' ' CYS . 1.6 t -96.61 135.92 22.05 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.414 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -55.16 -18.05 16.78 Favored 'Trans proline' 0 C--N 1.297 -2.144 0 C-N-CA 121.072 1.181 . . . . 0.0 112.86 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.64 -63.09 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.006 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.404 ' SG ' ' HB3' ' A' ' 117' ' ' CYS . 22.4 p -87.62 -28.44 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.86 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 50.53 25.0 1.79 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.851 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -166.53 122.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.845 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -123.91 143.09 50.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.732 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' CYS . . . . . 0.416 ' HG ' ' HD2' ' A' ' 125' ' ' PHE . 50.8 t -63.47 -51.08 67.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.907 0.384 . . . . 0.0 110.721 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.416 ' HD2' ' HG ' ' A' ' 124' ' ' CYS . 2.5 p90 -146.4 176.02 10.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.341 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.519 ' HA ' HG23 ' A' ' 129' ' ' ILE . 59.5 p -108.04 53.56 0.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.775 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -87.42 -40.39 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.742 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.5 22.82 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 111.581 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.519 HG23 ' HA ' ' A' ' 126' ' ' SER . 1.7 pt -62.87 -171.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.432 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -37.9 109.43 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 O-C-N 123.901 0.751 . . . . 0.0 110.393 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 167.96 -30.78 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 124.793 1.308 . . . . 0.0 111.014 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -84.88 72.65 10.75 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 120.296 -0.561 . . . . 0.0 111.068 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -93.39 26.93 2.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -59.93 -47.78 84.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.942 0.401 . . . . 0.0 110.514 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.4 tpt -73.95 125.96 29.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.812 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -144.62 96.35 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.818 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -124.23 144.44 49.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.605 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 p -177.56 -75.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.917 0.389 . . . . 0.0 111.007 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -99.03 73.09 0.53 Allowed Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 13.5 p 51.51 34.27 12.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.796 0.331 . . . . 0.0 110.294 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -82.0 105.63 13.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.617 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -71.03 148.45 47.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.671 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -121.03 141.8 50.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.572 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 89.8 m -66.29 130.29 42.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.499 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.536 179.902 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.636 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.45 119.09 4.56 Favored Glycine 0 CA--C 1.521 0.416 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.4 144.38 53.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.912 0.387 . . . . 0.0 110.202 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -87.94 22.08 2.48 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.555 0.693 . . . . 0.0 111.051 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.604 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.77 -12.22 16.0 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.777 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.437 HD23 ' HG3' ' A' ' 63' ' ' GLU . 44.2 mt -49.46 -22.97 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.181 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.71 -42.9 94.07 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.535 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.92 -40.29 6.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.639 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.28 -86.6 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.604 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 166.94 -78.38 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 O-C-N 123.906 0.754 . . . . 0.0 110.904 179.426 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -106.71 164.58 11.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.351 0.596 . . . . 0.0 110.438 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.2 t -80.94 137.11 36.12 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.869 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.35 -36.11 88.72 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 121.778 -0.248 . . . . 0.0 112.799 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.697 HG22 ' HG2' ' A' ' 118' ' ' PRO . 61.5 t -59.46 -40.04 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 5.6 p -114.19 -18.3 11.66 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.915 0.388 . . . . 0.0 111.128 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 64.14 38.35 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.347 0.594 . . . . 0.0 110.664 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -127.14 144.4 51.04 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.844 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -51.87 150.87 3.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.715 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.542 HD13 ' HB3' ' A' ' 78' ' ' PRO . 92.3 mt -78.02 105.11 9.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.298 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -79.24 166.89 38.74 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.94 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.31 -47.82 24.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.046 1.831 . . . . 0.0 112.982 -177.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -82.2 2.8 29.98 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.508 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.444 ' HG2' HD23 ' A' ' 72' ' ' LEU . 6.4 tpm_? -63.94 -25.76 68.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.311 -178.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.447 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 79.3 tt0 50.73 65.96 6.08 Favored Pre-proline 0 N--CA 1.446 -0.66 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.581 -178.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.542 ' HB3' HD13 ' A' ' 72' ' ' LEU . 22.6 Cg_exo -62.48 150.19 88.33 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 123.161 2.574 . . . . 0.0 112.279 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mtt85 -149.66 147.24 27.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.155 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.04 114.37 28.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.924 0.392 . . . . 0.0 111.264 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -66.37 165.25 24.58 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 121.066 0.46 . . . . 0.0 110.944 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -63.63 -14.71 44.32 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 C-N-CA 123.091 2.527 . . . . 0.0 112.392 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 18.5 p -90.5 2.87 55.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.352 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 75.41 47.94 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.835 0.71 . . . . 0.0 111.373 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -129.95 121.16 26.03 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.649 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -86.77 133.29 33.67 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.122 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.62 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -154.13 167.15 30.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.646 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -69.11 149.73 48.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.342 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -58.88 -44.43 91.12 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.077 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.45 97.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.881 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.3 m -70.0 -28.05 65.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.658 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.62 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.5 OUTLIER -69.09 -34.31 74.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.375 179.478 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.447 ' O ' ' HB3' ' A' ' 99' ' ' ALA . . . -51.1 -57.97 10.39 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.97 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.92 -11.87 23.27 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.053 1.836 . . . . 0.0 112.832 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.15 -37.44 80.15 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.014 0.435 . . . . 0.0 110.395 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -93.44 147.39 33.61 Favored Pre-proline 0 C--O 1.236 0.392 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.788 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.85 -34.15 24.79 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.056 1.837 . . . . 0.0 112.423 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.706 ' HB2' ' OD1' ' A' ' 111' ' ' ASP . . . -62.96 -44.88 94.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.598 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 93' ' ' GLY . . . -63.79 -41.79 97.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.622 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.19 158.81 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.656 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -84.45 102.59 12.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.319 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.7 t -65.26 137.43 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 70.1 m -89.57 154.11 20.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.51 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 84.17 -169.49 45.97 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.48 102.5 14.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 179.75 170.84 41.98 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.05 21.5 78.36 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.981 -0.847 . . . . 0.0 110.981 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.42 135.77 57.16 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.549 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 47.1 29.64 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.683 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -86.61 -155.46 27.08 Favored Glycine 0 CA--C 1.521 0.451 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.706 ' OD1' ' HB2' ' A' ' 98' ' ' ALA . 19.3 t0 73.43 82.38 0.12 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.013 0.435 . . . . 0.0 111.774 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.29 -18.65 35.63 Favored Glycine 0 C--N 1.332 0.332 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.2 t -117.67 -119.99 0.31 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.307 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 123' ' ' GLN . 3.2 m -61.21 155.32 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.941 0.4 . . . . 0.0 110.893 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 73.8 t -119.78 140.1 44.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -84.97 109.3 18.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.811 0.815 . . . . 0.0 111.165 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.1 t -103.5 130.95 22.57 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 114.385 -1.28 . . . . 0.0 109.552 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.697 ' HG2' HG22 ' A' ' 67' ' ' VAL . 36.7 Cg_exo -55.15 -15.4 10.58 Favored 'Trans proline' 0 C--N 1.302 -1.878 0 C-N-CA 121.236 1.291 . . . . 0.0 112.956 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.3 t -92.49 -62.54 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.34 -0.544 . . . . 0.0 112.148 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.6 p -95.49 -26.38 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.565 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 mptt 53.93 24.56 4.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.674 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 tm0? -162.82 128.61 3.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.607 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.411 ' O ' HG12 ' A' ' 114' ' ' VAL . 1.3 mm100 -136.59 139.06 41.86 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' CYS . . . . . 0.437 ' HG ' ' HD2' ' A' ' 125' ' ' PHE . 53.0 t -61.44 -49.4 76.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 110.295 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.437 ' HD2' ' HG ' ' A' ' 124' ' ' CYS . 5.7 p90 -145.04 177.06 9.04 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.415 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 3.8 p -122.29 48.37 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.278 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -87.15 -22.9 25.04 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.992 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -109.13 18.34 20.67 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.872 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.8 pt -64.06 -169.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.812 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.491 HG13 HD23 ' A' ' 92' ' ' LEU . 2.5 m -39.05 104.32 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.281 0 O-C-N 123.867 0.729 . . . . 0.0 110.237 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 162.91 -13.24 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 124.735 1.272 . . . . 0.0 111.427 -178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -90.85 20.33 4.87 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 119.752 -0.779 . . . . 0.0 111.116 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -42.09 105.77 0.05 Allowed 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.54 0.525 . . . . 0.0 110.952 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -85.05 -74.4 0.4 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 55.0 ttp -152.83 148.61 27.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 78.3 mtm-85 -86.28 65.6 9.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.141 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -55.41 125.27 20.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.783 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 p -179.54 96.63 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.781 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 67.88 24.33 74.3 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 62.9 m 57.26 19.38 4.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.695 0.283 . . . . 0.0 110.643 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.95 -40.08 91.01 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.909 0.385 . . . . 0.0 110.862 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -71.07 149.26 46.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.861 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 60.96 45.73 9.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.583 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 98.1 m -63.57 131.0 46.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.576 -179.694 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.713 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.95 99.87 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.47 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . -64.22 139.38 58.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 0.0 110.585 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.84 20.23 4.94 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.499 0.666 . . . . 0.0 110.651 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.87 -11.68 14.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.819 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.426 HD23 ' HG3' ' A' ' 63' ' ' GLU . 45.8 mt -48.27 -23.51 0.91 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.894 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.53 -44.01 93.29 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.713 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 mt -104.44 -41.83 5.63 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.716 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.81 -89.99 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 165.27 -67.72 0.0 OUTLIER 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.93 0.769 . . . . 0.0 111.455 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -118.11 163.85 16.01 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.271 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 5.3 t -81.51 140.04 34.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.993 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.27 -38.65 93.92 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.334 -0.46 . . . . 0.0 113.283 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -59.96 -44.07 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 26.7 p -106.33 -20.38 13.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.931 0.396 . . . . 0.0 111.582 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 65.04 36.03 7.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.503 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.11 146.5 50.68 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.379 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.0 tpp180 -52.02 148.64 5.86 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.466 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.546 HD13 ' HB3' ' A' ' 78' ' ' PRO . 75.6 mt -73.43 101.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.244 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.446 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 3.7 ptm180 -71.4 166.94 34.3 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.753 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -55.39 -43.1 61.64 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.267 1.978 . . . . 0.0 113.172 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.446 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.7 mt-10 -87.06 2.7 48.84 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.431 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.408 ' HG2' HD23 ' A' ' 72' ' ' LEU . 3.7 tpm_? -64.68 -25.66 68.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.677 0.275 . . . . 0.0 111.333 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 47.8 68.92 3.04 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.809 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.546 ' HB3' HD13 ' A' ' 72' ' ' LEU . 38.9 Cg_endo -66.98 140.77 55.75 Favored 'Trans proline' 0 C--N 1.298 -2.122 0 C-N-CA 122.971 2.447 . . . . 0.0 111.791 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -135.22 145.55 47.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.583 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 tp -100.29 122.18 42.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.417 HD11 HD22 ' A' ' 92' ' ' LEU . 2.2 mp -81.31 166.31 39.15 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.82 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -61.93 -16.68 51.2 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 123.015 2.476 . . . . 0.0 112.139 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.7 p -88.49 -1.22 57.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.403 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.27 45.66 0.19 Allowed 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 123.758 0.661 . . . . 0.0 110.998 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -129.71 122.23 28.5 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.443 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -86.52 138.06 32.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.217 -179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.609 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -153.46 165.64 35.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.731 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -68.73 138.77 55.16 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -56.28 -42.5 77.58 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.025 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.07 92.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 87.1 m -65.81 -36.39 83.36 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.156 0.503 . . . . 0.0 110.349 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.609 HD21 ' HB3' ' A' ' 87' ' ' ALA . 92.0 mt -66.72 -29.66 69.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.173 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.32 -60.67 6.06 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.79 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.57 -16.5 55.02 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.188 1.925 . . . . 0.0 112.452 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.58 -24.59 65.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.655 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -116.5 88.38 23.85 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -78.42 122.16 5.49 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.513 2.142 . . . . 0.0 112.756 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.12 96.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.952 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 50.4 28.99 3.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.546 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.79 88.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.564 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.35 -40.22 89.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.756 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.9 t -148.66 130.09 14.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.4 m -64.22 -40.6 96.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.568 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 93.25 145.54 17.42 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -62.75 -44.61 95.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.85 0.357 . . . . 0.0 110.367 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.0 160.47 34.05 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.66 85.98 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -104.71 25.73 9.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 110.462 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.94 85.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.473 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.74 113.5 3.98 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -177.42 58.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.09 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 101.82 -15.96 56.47 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 -179.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 81.3 p -107.07 -121.23 0.24 Allowed 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.289 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 26.5 m -60.5 141.72 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-O 121.137 0.494 . . . . 0.0 109.94 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 50.6 t -107.47 131.12 58.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.581 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 49.4 p-10 -79.29 84.54 5.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.072 0.939 . . . . 0.0 109.901 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.61 137.08 77.37 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.822 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -55.34 -18.69 19.57 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 CA-C-N 120.21 1.111 . . . . 0.0 113.182 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.7 t -95.58 -63.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.479 -0.489 . . . . 0.0 112.202 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 20.7 p -86.6 -28.76 23.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.678 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 49.55 26.14 1.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.975 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -165.31 119.82 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.592 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -123.33 171.19 9.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.621 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 96.1 m -94.78 -51.94 4.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.478 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -145.02 174.98 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.606 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.516 ' HB2' HD13 ' A' ' 129' ' ' ILE . 64.8 p -108.43 50.12 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.054 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.05 -38.75 15.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.567 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.13 19.09 20.88 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.871 0.367 . . . . 0.0 111.774 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.516 HD13 ' HB2' ' A' ' 126' ' ' SER . 8.6 pt -61.41 -170.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.731 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.3 m -38.89 105.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 O-C-N 123.817 0.698 . . . . 0.0 110.547 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 174.91 -34.21 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.583 0 O-C-N 124.286 0.991 . . . . 0.0 110.812 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -84.51 72.53 10.63 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.815 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -68.76 138.14 54.61 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.936 0.398 . . . . 0.0 111.161 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -107.46 -177.09 3.25 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.39 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 98.2 mtp -62.0 149.53 40.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.233 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -79.37 59.3 2.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.201 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -62.05 117.43 5.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.321 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.47 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 85.1 p -165.51 173.0 11.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.693 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -57.99 -34.87 73.72 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 71.9 m -60.33 -39.02 85.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.978 0.418 . . . . 0.0 110.509 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -81.6 139.71 34.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.53 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -158.47 164.2 36.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.8 88.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 57.51 32.91 22.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.54 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 57.3 t0 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.458 -179.949 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -130.41 -96.09 0.74 Allowed Glycine 0 C--N 1.33 0.196 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.02 143.7 44.9 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.734 ' OE1' ' HB2' ' A' ' 142' ' ' ALA . 98.0 mt-10 -89.54 24.89 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.566 0.698 . . . . 0.0 111.064 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.673 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.69 -12.05 14.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.65 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.404 HD23 ' HG3' ' A' ' 63' ' ' GLU . 39.6 mt -48.65 -23.3 0.98 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.171 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.55 -43.08 93.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.01 0.433 . . . . 0.0 110.641 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.8 mt -104.39 -40.61 6.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.647 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.36 -86.71 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.673 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 166.55 -81.02 0.0 OUTLIER 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.79 0.681 . . . . 0.0 110.96 179.088 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.5 p-80 -113.35 163.21 15.14 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.34 0.591 . . . . 0.0 110.416 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 12.8 t -76.11 134.47 39.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.159 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -36.92 92.88 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 116.407 -0.36 . . . . 0.0 112.9 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.5 t -60.04 -42.59 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 22.2 p -110.83 -18.16 13.17 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 63.72 37.84 9.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.391 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -125.31 145.89 49.81 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.773 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -52.67 147.44 8.63 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.26 109.79 8.03 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.874 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -77.71 157.51 79.46 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.112 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.34 -33.76 94.09 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.603 1.535 . . . . 0.0 111.249 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -90.4 -2.08 57.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.375 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -23.91 65.96 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 111.655 -178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.41 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 85.9 tt0 56.12 66.95 3.12 Favored Pre-proline 0 N--CA 1.446 -0.639 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.857 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.41 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.0 Cg_exo -61.99 146.93 96.06 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.995 2.463 . . . . 0.0 111.995 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -140.44 148.15 40.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.417 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 tp -102.69 130.0 49.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.173 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -89.28 166.58 20.89 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 121.081 0.467 . . . . 0.0 111.21 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.43 -20.72 69.59 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 123.268 2.645 . . . . 0.0 112.691 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.6 p -87.42 0.78 55.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.047 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 74.67 47.48 0.12 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.892 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.481 ' CE1' HG11 ' A' ' 119' ' ' VAL . 45.6 m170 -129.6 123.98 32.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.151 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -86.64 131.47 34.14 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.257 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.646 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -144.11 162.52 36.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.485 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.09 149.12 48.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.344 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 t -60.04 -46.52 89.24 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.396 0.617 . . . . 0.0 110.199 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.99 95.58 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.785 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.6 m -70.08 -25.8 63.69 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.959 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.646 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.2 OUTLIER -69.89 -34.36 73.44 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.542 179.623 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -52.99 -58.68 10.94 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.815 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.77 -18.63 21.91 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 123.008 2.472 . . . . 0.0 112.582 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.05 -36.68 75.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.788 0.327 . . . . 0.0 110.344 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.84 120.25 79.79 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.053 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.01 154.79 52.93 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.93 1.753 . . . . 0.0 112.804 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.441 ' O ' ' HB3' ' A' ' 99' ' ' ALA . . . -90.29 44.77 1.22 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.116 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 98' ' ' ALA . . . 67.3 8.31 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.999 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.53 97.72 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-O 120.84 0.353 . . . . 0.0 110.658 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -92.71 107.59 19.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.784 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 61.9 m -88.36 65.18 7.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 90.6 p -156.97 163.99 38.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.587 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 135.24 139.34 4.02 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -66.29 -41.65 89.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.816 0.341 . . . . 0.0 111.051 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -61.07 -40.64 98.8 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -152.83 160.1 28.84 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.71 -38.88 82.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.972 0.415 . . . . 0.0 110.359 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -127.92 157.96 39.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.394 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -80.35 -158.06 16.61 Favored Glycine 0 CA--C 1.519 0.293 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.4 t0 74.08 81.37 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.889 0.376 . . . . 0.0 110.572 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.0 -18.13 37.15 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 67.6 p -115.57 -118.85 0.32 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.423 ' O ' HG23 ' A' ' 114' ' ' VAL . 21.3 m -60.68 132.95 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.164 0.507 . . . . 0.0 110.312 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.53 131.27 56.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.066 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -71.14 135.56 47.69 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.591 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.466 ' O ' ' N ' ' A' ' 121' ' ' LYS . 24.3 t -115.75 132.86 22.95 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.814 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -54.33 -17.83 13.04 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 CA-C-N 120.794 1.319 . . . . 0.0 112.493 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.481 HG11 ' CE1' ' A' ' 85' ' ' HIS . 2.7 t -94.38 -50.54 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.48 -31.31 11.35 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.452 0.644 . . . . 0.0 110.265 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.3 mptt 57.65 26.98 13.59 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.831 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -169.64 110.44 0.44 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.779 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -103.25 160.51 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.683 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 74.7 m -93.46 -44.42 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -145.3 167.78 22.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.534 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.564 ' HB2' HD13 ' A' ' 129' ' ' ILE . 51.3 p -105.16 44.45 1.03 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -88.42 -36.34 16.57 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -108.29 21.25 17.59 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.564 HD13 ' HB2' ' A' ' 126' ' ' SER . 13.3 pt -70.33 -170.02 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.424 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.501 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.7 OUTLIER -38.73 108.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 O-C-N 123.782 0.676 . . . . 0.0 110.39 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.1 -27.33 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 124.613 1.196 . . . . 0.0 110.772 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -84.41 74.46 10.36 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.753 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -85.67 114.02 22.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.031 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -96.79 -179.68 4.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.307 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 17.0 ptm -49.33 159.9 0.28 Allowed 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -98.36 80.24 2.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.446 -179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -80.7 106.61 12.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.553 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.1 p -170.34 156.59 5.73 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.42 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 56.85 34.44 65.21 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 49.7 m 57.44 40.7 27.09 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.149 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -105.6 140.73 38.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.734 ' HB2' ' OE1' ' A' ' 57' ' ' GLU . . . -150.21 141.53 23.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.571 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.51 98.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.46 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 69.4 p -135.17 162.54 32.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.584 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t0 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.523 179.868 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.642 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -160.76 -98.24 0.13 Allowed Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.506 ' HB3' ' HE ' ' A' ' 71' ' ' ARG . . . -60.18 138.34 57.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 110.317 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -92.03 21.87 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.461 0.648 . . . . 0.0 110.847 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.606 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.04 -12.42 11.69 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.815 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.455 HD23 ' HG3' ' A' ' 63' ' ' GLU . 35.5 mt -49.58 -23.64 1.76 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.347 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.39 -43.27 92.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 68.5 mt -104.19 -40.62 6.07 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.936 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.8 -87.87 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.606 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.0 OUTLIER 165.79 -79.28 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 O-C-N 124.06 0.85 . . . . 0.0 110.969 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -108.26 164.43 12.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.166 0.508 . . . . 0.0 110.513 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.518 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 10.6 t -76.17 135.03 39.76 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.931 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.41 -37.8 94.2 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 121.442 -0.409 . . . . 0.0 113.011 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.8 t -62.02 -42.71 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.53 -16.05 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.03 0.443 . . . . 0.0 110.962 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.12 29.22 16.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.415 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -114.89 143.83 44.51 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.496 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.506 ' HE ' ' HB3' ' A' ' 56' ' ' ALA . 33.2 ttt180 -54.4 151.35 7.71 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.769 -178.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.54 104.2 8.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.192 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -77.34 157.22 80.82 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.363 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -56.16 -38.65 94.58 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 C-N-CA 121.787 1.658 . . . . 0.0 111.064 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -86.86 -1.88 58.15 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.898 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -67.86 -24.24 65.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.982 0.42 . . . . 0.0 111.134 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.431 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 78.5 tt0 57.65 65.71 3.3 Favored Pre-proline 0 N--CA 1.445 -0.705 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.296 -178.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.5 Cg_exo -63.05 146.45 94.59 Favored 'Trans proline' 0 C--N 1.301 -1.931 0 C-N-CA 122.367 2.044 . . . . 0.0 111.221 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -140.15 148.79 42.15 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.294 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.6 tp -103.38 127.53 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.142 0.496 . . . . 0.0 111.445 -178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 92' ' ' LEU . 4.4 mp -89.77 164.62 28.2 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.234 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.41 -6.73 19.8 Favored 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 123.037 2.491 . . . . 0.0 112.532 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 20.0 p -94.11 -0.87 55.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.404 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 77.46 41.52 0.14 Allowed 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 123.926 0.766 . . . . 0.0 110.969 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.479 ' NE2' HG11 ' A' ' 119' ' ' VAL . 33.4 m170 -134.58 119.2 18.11 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.679 178.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.5 m -87.02 140.26 29.74 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.712 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -152.41 164.1 38.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.578 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -65.34 137.59 57.62 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -56.32 -43.43 78.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.516 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.74 91.12 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 84.2 m -67.48 -33.55 75.34 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.53 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.712 HD21 ' HB3' ' A' ' 87' ' ' ALA . 74.7 mt -65.53 -37.33 86.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.04 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -47.57 -63.71 3.28 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.78 -27.03 69.47 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.882 2.388 . . . . 0.0 111.787 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.02 -39.67 86.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.559 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.43 122.94 85.71 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.054 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.05 143.99 81.24 Favored 'Trans proline' 0 N--CA 1.501 1.94 0 C-N-CA 122.09 1.86 . . . . 0.0 112.385 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -131.54 64.88 1.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.591 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.96 138.94 58.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.445 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.27 98.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -122.36 130.0 52.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.629 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -44.37 97.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.707 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.4 m 53.0 39.17 28.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.477 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 80.52 -172.65 54.6 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -60.98 -45.83 93.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 0.0 110.475 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -86.38 179.39 49.33 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.11 2.66 90.58 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 120.979 -0.629 . . . . 0.0 111.671 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -140.04 144.3 36.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.837 0.351 . . . . 0.0 110.481 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.54 -40.1 93.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.523 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -173.52 -103.62 0.17 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.9 t0 70.23 76.2 0.2 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.924 0.392 . . . . 0.0 110.972 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.64 -13.16 46.77 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.4 p -115.99 -120.64 0.3 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.549 -0.325 . . . . 0.0 110.451 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.0 m -64.24 151.66 9.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.058 0.456 . . . . 0.0 110.673 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.89 133.89 65.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.819 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.23 113.71 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.151 0.501 . . . . 0.0 110.025 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.96 138.31 19.77 Favored Pre-proline 0 C--O 1.213 -0.828 0 CA-C-N 115.228 -0.897 . . . . 0.0 108.832 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.66 -15.41 48.58 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 121.165 1.243 . . . . 0.0 112.58 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.479 HG11 ' NE2' ' A' ' 85' ' ' HIS . 52.1 t -94.46 -61.99 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.576 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -90.45 -24.85 20.6 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.433 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.7 mptt 49.75 24.25 1.2 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.839 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.13 116.37 0.84 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -118.38 156.97 28.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.615 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 6.4 t -83.46 -49.95 8.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.15 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -141.19 176.8 8.55 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.489 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.03 50.79 1.11 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.56 0.695 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -85.03 -26.84 26.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.462 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.421 ' OD1' ' ND2' ' A' ' 132' ' ' ASN . 3.3 t70 -113.62 23.72 12.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 111.43 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 15.3 pt -60.16 -172.34 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.784 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.406 HG12 ' CD1' ' A' ' 92' ' ' LEU . 2.5 m -41.24 104.58 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 O-C-N 123.758 0.662 . . . . 0.0 110.698 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.38 -33.52 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.405 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.421 ' ND2' ' OD1' ' A' ' 128' ' ' ASP . 9.7 m120 -82.96 68.57 9.5 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.573 -178.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -95.67 32.73 1.77 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -61.71 -39.04 90.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.55 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.7 mmt -95.14 127.61 41.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.104 0.478 . . . . 0.0 110.9 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -136.51 45.4 2.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.754 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -62.8 145.2 55.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.7 p -179.87 -40.64 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 92.46 150.77 26.65 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m 51.53 28.14 4.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 110.504 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -61.47 -44.51 96.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.1 143.79 57.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.535 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.73 150.73 34.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.563 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 81.8 p -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.566 -179.959 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.657 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.26 -39.67 98.01 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.558 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . -56.65 139.7 49.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.339 . . . . 0.0 110.116 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -89.27 12.39 16.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -58.97 -11.29 3.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.11 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.478 HD23 ' HG3' ' A' ' 63' ' ' GLU . 55.1 mt -47.39 -28.15 1.96 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.515 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -49.26 -45.98 45.61 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.67 -40.84 5.86 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.599 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.1 -83.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 123.432 0.457 . . . . 0.0 109.777 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.617 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.9 OUTLIER 164.65 -76.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.091 0.869 . . . . 0.0 111.303 179.383 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 -103.06 165.2 11.16 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.386 0.612 . . . . 0.0 110.41 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 20.2 t -81.35 135.94 35.71 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.205 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.09 92.67 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 116.521 -0.308 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.37 -41.16 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 4.4 p -113.56 -16.16 12.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.923 0.392 . . . . 0.0 111.16 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 62.99 38.83 10.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.319 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -128.1 145.28 51.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.098 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -51.69 153.78 2.25 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.336 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 78' ' ' PRO . 85.5 mt -82.56 102.42 11.39 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.863 -178.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -66.56 162.17 52.73 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.151 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.43 ' HG3' ' HB2' ' A' ' 142' ' ' ALA . 31.6 Cg_exo -58.31 -39.24 86.06 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 121.924 1.75 . . . . 0.0 111.05 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -90.17 0.81 56.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.512 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -66.88 -23.74 66.04 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.126 0.489 . . . . 0.0 110.784 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 50.61 74.51 0.79 Allowed Pre-proline 0 N--CA 1.45 -0.429 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.583 ' HB3' HD13 ' A' ' 72' ' ' LEU . 65.7 Cg_endo -70.71 152.81 64.67 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 123.03 2.487 . . . . 0.0 112.283 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -147.14 152.43 38.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.656 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 tp -108.92 128.41 54.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.313 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -83.84 165.58 38.66 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.295 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -62.4 -16.7 53.37 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 123.126 2.551 . . . . 0.0 112.251 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.5 p -88.42 -0.9 57.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.4 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.34 49.17 0.07 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.432 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -133.99 124.02 25.59 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.605 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.4 m -86.52 140.28 30.06 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.307 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.584 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -156.08 163.83 39.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.916 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.3 m -65.14 149.87 49.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.211 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.3 t -59.99 -46.35 89.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.645 0.736 . . . . 0.0 109.796 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.23 96.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.271 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 99.4 m -69.88 -26.79 64.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 109.729 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.584 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -66.9 -38.25 85.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.696 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.9 -60.17 7.31 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.81 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.21 -29.29 37.15 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 123.283 2.655 . . . . 0.0 112.372 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.84 -38.4 81.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.186 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.56 116.49 66.41 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.04 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -58.39 146.01 91.69 Favored 'Trans proline' 0 N--CA 1.501 1.914 0 C-N-CA 122.114 1.876 . . . . 0.0 112.421 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -142.67 -87.74 0.14 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.74 -41.38 99.16 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.841 0.353 . . . . 0.0 110.782 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.12 94.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.882 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -90.22 99.69 12.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.74 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.2 m -109.24 -52.27 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.483 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 98.7 p -112.53 -18.3 12.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.999 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 86.13 173.09 49.14 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -165.84 164.07 18.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.848 0.356 . . . . 0.0 110.82 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 72.28 18.22 77.99 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 74.12 18.08 79.66 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -149.3 153.57 37.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.827 0.346 . . . . 0.0 110.519 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -142.29 145.54 34.11 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.471 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -106.35 -152.12 19.42 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t0 71.95 79.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.892 0.377 . . . . 0.0 111.006 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.58 -16.43 40.77 Favored Glycine 0 N--CA 1.453 -0.213 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.5 p -114.91 -120.55 0.3 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.647 -0.276 . . . . 0.0 110.356 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.413 ' H ' HG13 ' A' ' 114' ' ' VAL . 2.7 m -66.96 138.33 23.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.415 -179.34 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.1 t -110.47 132.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.8 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 122.52 25.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.731 0.777 . . . . 0.0 109.944 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 49.7 t -108.94 135.52 20.13 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.655 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.41 -11.19 15.64 Favored 'Trans proline' 0 C--N 1.302 -1.897 0 C-N-CA 121.084 1.19 . . . . 0.0 112.679 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -93.97 -62.41 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.648 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 10.2 p -96.8 -24.73 15.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.936 0.398 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 54.73 29.54 11.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.808 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -156.48 139.03 14.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.118 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -141.64 158.42 43.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.714 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 34.6 t -94.66 -55.04 3.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.169 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -144.0 175.18 10.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.564 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.531 ' HA ' HG23 ' A' ' 129' ' ' ILE . 78.9 p -104.46 54.24 0.73 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.674 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -87.62 -43.03 12.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.528 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -107.8 19.23 20.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.667 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.531 HG23 ' HA ' ' A' ' 126' ' ' SER . 3.7 pt -59.02 -172.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.624 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.477 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -39.33 112.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 O-C-N 123.827 0.704 . . . . 0.0 110.608 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 165.74 -29.62 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 124.621 1.201 . . . . 0.0 110.713 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -87.64 101.14 13.36 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.742 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 48.2 p90 -108.37 143.63 37.02 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.608 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -108.66 -81.01 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 16.8 tpt -145.09 141.24 28.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -89.27 44.55 1.22 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.742 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -81.82 146.41 29.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.686 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 52.7 p -142.52 -28.13 0.6 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 133.81 -169.34 22.89 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 99.0 p -68.06 -10.09 51.11 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.399 -0.4 . . . . 0.0 110.545 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -60.41 -29.98 69.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.176 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.43 ' HB2' ' HG3' ' A' ' 74' ' ' PRO . . . -61.2 138.4 58.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.496 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -155.27 152.39 29.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 70.8 p -70.04 -26.21 63.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.446 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 67.4 t0 . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.352 179.935 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.694 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.54 145.19 40.06 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 71' ' ' ARG . . . 61.92 113.86 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.12 0.486 . . . . 0.0 110.471 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -88.93 30.72 0.91 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.442 0.639 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.634 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.92 -12.5 18.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.529 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.438 HD23 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mt -49.23 -23.63 1.43 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.242 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -59.24 -43.21 92.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.989 0.423 . . . . 0.0 110.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.0 mt -104.3 -40.64 6.04 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.94 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.27 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.634 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.9 OUTLIER 165.12 -79.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 O-C-N 123.987 0.804 . . . . 0.0 110.978 178.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -106.2 166.4 10.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.239 0.542 . . . . 0.0 110.688 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.6 t -79.2 135.34 36.77 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.259 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.28 -37.91 93.28 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.615 -0.326 . . . . 0.0 112.851 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.32 -41.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.0 p -110.04 -18.07 13.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.95 0.405 . . . . 0.0 111.204 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.34 39.67 9.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.53 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -128.76 144.1 51.08 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.123 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.562 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 7.8 ttm180 -50.7 152.6 1.97 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.366 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -81.14 112.47 18.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.977 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -82.78 158.38 65.35 Favored Pre-proline 0 N--CA 1.462 0.162 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.394 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.12 -40.24 86.15 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.063 1.842 . . . . 0.0 111.831 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -85.97 -0.32 55.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.43 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -67.51 -24.99 65.63 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 111.482 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.435 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 81.9 tt0 56.27 65.72 3.97 Favored Pre-proline 0 N--CA 1.444 -0.766 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.841 -177.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.435 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.4 Cg_exo -63.08 147.34 94.43 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.736 2.291 . . . . 0.0 111.545 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.432 ' HD3' HG23 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -143.69 149.54 37.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.241 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.99 123.56 48.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.119 0.485 . . . . 0.0 112.154 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.586 HD11 HD22 ' A' ' 92' ' ' LEU . 2.7 mp -77.37 165.73 49.52 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.626 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -64.84 -16.17 54.03 Favored 'Trans proline' 0 C--N 1.307 -1.61 0 C-N-CA 123.245 2.63 . . . . 0.0 112.16 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 9.9 p -91.12 1.4 57.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.101 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 75.76 49.81 0.07 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.566 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.44 ' CD2' HG11 ' A' ' 119' ' ' VAL . 32.7 m170 -134.14 125.43 27.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.752 178.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.8 m -85.58 142.46 29.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.084 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.691 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -156.52 163.06 39.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.673 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.6 m -69.61 135.36 49.87 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.433 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.2 t -56.23 -39.8 73.09 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.634 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.97 88.38 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.7 m -67.24 -36.84 82.49 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.624 0.725 . . . . 0.0 110.215 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.691 HD21 ' HB3' ' A' ' 87' ' ' ALA . 73.3 mt -64.29 -35.96 82.54 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.776 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.47 -62.92 4.06 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.726 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.97 -21.4 27.89 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.512 2.142 . . . . 0.0 112.03 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.443 ' O ' HG13 ' A' ' 115' ' ' VAL . . . -68.57 75.96 0.28 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -160.48 147.79 12.41 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -54.74 -40.45 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 122.175 1.916 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 45.32 30.72 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.116 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -120.76 104.75 10.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.832 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.46 99.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.491 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -73.25 133.06 43.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.73 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.4 m -62.35 145.62 53.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.367 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.5 t -147.85 147.45 29.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.717 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.35 158.42 29.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -63.55 143.69 57.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.762 0.315 . . . . 0.0 110.622 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 70.99 -155.14 52.65 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -70.78 157.91 53.61 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.859 -0.897 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.29 150.2 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.764 0.316 . . . . 0.0 110.489 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 114' ' ' VAL . . . -152.99 152.36 31.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.677 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 175.91 179.56 46.48 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.9 t0 63.45 70.19 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.945 0.402 . . . . 0.0 110.8 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.03 -8.51 38.89 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.6 p -116.16 -120.09 0.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.405 ' H ' HG13 ' A' ' 114' ' ' VAL . 2.4 m -62.72 145.11 13.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.074 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 95' ' ' ALA . 90.6 t -112.09 133.29 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.21 0.528 . . . . 0.0 111.63 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -74.22 106.42 5.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.829 0.824 . . . . 0.0 110.057 179.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 121' ' ' LYS . 7.6 t -104.05 126.99 30.21 Favored Pre-proline 0 C--O 1.202 -1.406 0 CA-C-N 114.756 -1.111 . . . . 0.0 108.63 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.32 -9.08 22.54 Favored 'Trans proline' 0 C--N 1.296 -2.226 0 CA-C-N 121.188 1.46 . . . . 0.0 113.171 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.44 HG11 ' CD2' ' A' ' 85' ' ' HIS . 40.5 t -85.82 -54.88 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.147 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.4 p -105.49 -27.79 11.2 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.118 0.485 . . . . 0.0 110.482 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 0.3 OUTLIER 62.05 35.9 15.7 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.209 178.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -166.74 141.84 4.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -150.22 158.75 44.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.638 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 79.2 m -96.04 -47.38 6.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.438 . . . . 0.0 110.089 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -142.61 176.45 9.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.355 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.55 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.6 OUTLIER -120.87 46.74 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.374 179.601 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.23 -30.45 19.69 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.349 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -106.19 16.74 24.5 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.55 HD13 ' HB2' ' A' ' 126' ' ' SER . 44.5 pt -70.95 -169.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.99 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.432 HG23 ' HD3' ' A' ' 79' ' ' ARG . 0.2 OUTLIER -41.67 109.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 O-C-N 123.727 0.642 . . . . 0.0 110.075 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 163.92 -34.25 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 124.827 1.33 . . . . 0.0 111.072 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -59.59 -42.23 92.08 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 75.9 t80 37.9 73.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.965 0.79 . . . . 0.0 111.193 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.76 -50.3 74.36 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.99 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.3 ttt 178.03 -165.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.385 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.7 mtm180 -116.6 92.81 3.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.807 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.93 -36.62 79.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -43.36 130.02 4.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.922 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -84.55 57.93 5.01 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 57.1 m 52.05 37.9 22.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.769 0.319 . . . . 0.0 110.679 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -72.0 132.18 43.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.778 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -150.23 150.24 31.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.592 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -154.08 150.58 28.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.718 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 71.0 p -89.44 -14.34 35.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.974 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.0 t0 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.221 -179.937 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.582 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 83.06 0.99 90.59 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . 60.79 109.12 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.001 0.429 . . . . 0.0 110.449 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -86.74 26.59 1.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.49 0.662 . . . . 0.0 110.709 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.15 -12.1 11.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.584 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.438 HD23 ' HG3' ' A' ' 63' ' ' GLU . 46.3 mt -47.48 -23.8 0.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.989 179.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -59.66 -43.09 94.07 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.643 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.0 mt -103.96 -40.95 6.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.366 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.46 -88.28 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.683 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.4 mt-10 164.6 -81.17 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.85 0.718 . . . . 0.0 110.891 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -102.22 168.91 9.05 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.095 0.474 . . . . 0.0 110.134 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.423 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 12.4 t -84.34 138.43 32.89 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.032 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.28 -36.41 89.55 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.584 -0.341 . . . . 0.0 113.075 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.7 t -59.61 -43.16 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.7 p -109.0 -20.53 13.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.968 0.414 . . . . 0.0 111.305 -178.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 65.62 34.26 7.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.421 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -126.42 145.69 50.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.119 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 9.6 ttm-85 -49.71 149.75 2.37 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.531 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.18 115.58 14.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.772 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -80.75 162.08 61.53 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.507 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.27 -38.08 46.41 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 121.791 1.66 . . . . 0.0 111.585 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.65 0.61 57.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.821 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -24.28 66.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.91 0.386 . . . . 0.0 111.522 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 55.92 69.0 2.04 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-O 121.289 0.566 . . . . 0.0 110.206 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.54 151.68 70.36 Favored 'Trans proline' 0 C--N 1.299 -2.027 0 C-N-CA 123.442 2.762 . . . . 0.0 111.963 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -144.87 167.01 23.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.821 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.38 126.26 51.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.569 HD11 HD22 ' A' ' 92' ' ' LEU . 3.9 mp -86.63 164.68 36.39 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.278 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.46 -6.0 18.06 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.926 2.417 . . . . 0.0 112.063 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -94.33 2.34 55.83 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.333 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 76.42 39.15 0.27 Allowed 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.513 0.673 . . . . 0.0 111.222 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.494 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.1 m170 -134.5 120.29 19.52 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.944 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.9 m -86.56 142.83 28.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.779 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -154.13 167.41 29.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.882 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.437 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -71.32 136.13 47.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.6 t -53.04 -42.96 66.25 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.92 91.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.2 m -68.44 -33.58 74.45 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.659 0.742 . . . . 0.0 110.495 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.779 HD21 ' HB3' ' A' ' 87' ' ' ALA . 70.4 mt -63.97 -36.37 83.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.162 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.77 -65.27 2.94 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.97 -29.73 74.8 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.016 2.477 . . . . 0.0 111.551 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.69 -38.17 77.67 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.463 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.68 123.24 71.11 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.461 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -53.82 143.6 58.68 Favored 'Trans proline' 0 N--CA 1.498 1.758 0 C-N-CA 122.006 1.804 . . . . 0.0 112.192 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 99' ' ' ALA . . . -109.01 41.51 1.6 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.44 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 98' ' ' ALA . . . 64.99 11.49 7.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.7 94.19 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 120.929 0.395 . . . . 0.0 110.632 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -156.58 -178.93 7.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.696 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.3 t -111.41 136.06 51.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.532 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.6 m -60.97 -41.03 95.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.549 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 178.2 172.24 42.41 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -67.08 139.67 57.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.683 0.278 . . . . 0.0 110.423 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 71.66 -170.4 48.83 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 56.48 -131.51 51.05 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -124.82 124.46 42.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.857 0.36 . . . . 0.0 110.594 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.37 92.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.419 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 122.8 -176.91 16.59 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.7 t0 67.89 83.84 0.16 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 110.924 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.42 -18.26 35.81 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.7 p -115.22 -120.71 0.3 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.656 -0.272 . . . . 0.0 110.318 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.431 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.0 m -63.17 142.94 16.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.936 0.398 . . . . 0.0 110.203 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 96.7 t -113.48 139.95 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.253 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.4 116.17 21.75 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.395 0.617 . . . . 0.0 109.894 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 48.9 t -106.04 133.99 19.96 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.196 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.73 -11.35 11.54 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.272 1.315 . . . . 0.0 113.302 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.494 HG11 ' NE2' ' A' ' 85' ' ' HIS . 15.0 t -94.59 -62.14 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.475 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.7 p -97.14 -26.55 14.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.017 0.436 . . . . 0.0 110.568 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.6 mptt 56.25 27.51 11.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.707 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -160.37 136.24 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.947 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -141.6 161.81 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.67 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' CYS . . . . . 0.564 ' HG ' ' HD1' ' A' ' 125' ' ' PHE . 11.7 p -95.28 -43.81 7.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.363 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.564 ' HD1' ' HG ' ' A' ' 124' ' ' CYS . 50.8 m-85 -143.26 177.08 8.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.896 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.445 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.2 OUTLIER -119.99 53.53 1.07 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 111.58 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -88.65 -30.34 19.25 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.699 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -112.62 23.06 13.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.615 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.445 HD13 ' HB2' ' A' ' 126' ' ' SER . 18.0 pt -70.15 -172.95 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 120.882 0.372 . . . . 0.0 111.35 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -45.25 106.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.574 179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 163.87 -40.1 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 124.973 1.421 . . . . 0.0 111.106 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -89.99 72.88 7.41 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.691 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 p90 -68.14 143.56 55.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.108 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -78.38 0.57 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.395 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.0 mmm -129.42 147.11 51.21 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.616 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.6 mtm-85 -110.31 42.17 1.61 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.454 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -73.15 153.14 40.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.641 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.611 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 79.2 p -175.99 -69.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.878 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -157.11 -109.25 0.29 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 6.2 t -85.37 61.77 7.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 0.0 110.43 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -58.51 -38.4 77.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.695 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.46 -36.44 75.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.72 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -66.08 145.59 55.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.577 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 74.2 p -68.25 -29.14 67.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.527 179.877 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.724 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.69 158.21 53.43 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 58.63 94.31 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.884 0.373 . . . . 0.0 110.694 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -86.38 42.54 1.0 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.653 0.739 . . . . 0.0 110.73 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.715 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.85 -13.3 23.09 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.999 -1.0 . . . . 0.0 111.366 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.441 HD23 ' HG3' ' A' ' 63' ' ' GLU . 32.3 mt -47.31 -24.58 0.79 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.411 0.444 . . . . 0.0 110.969 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -60.28 -44.35 95.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.989 0.423 . . . . 0.0 110.806 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 80' ' ' LEU . 83.1 mt -103.58 -42.63 5.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.658 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.07 -90.63 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.715 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.4 OUTLIER 166.22 -80.13 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.703 0.801 . . . . 0.0 111.298 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -107.59 165.42 11.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.359 0.6 . . . . 0.0 110.346 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.426 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 40.9 t -79.62 147.76 31.93 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.606 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -35.98 40.35 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.187 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 68.1 t -62.57 -37.6 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.932 0.396 . . . . 0.0 111.498 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 -26.19 10.76 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.383 -178.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 66.51 24.66 10.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.791 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -122.26 150.3 42.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.236 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -50.91 150.17 3.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.28 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.8 mt -80.59 118.41 22.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.347 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.28 165.72 16.25 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.022 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -52.56 -51.19 11.69 Favored 'Trans proline' 0 C--N 1.303 -1.862 0 C-N-CA 122.164 1.909 . . . . 0.0 112.96 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -72.14 -7.42 49.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.079 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.28 -24.34 64.86 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 121.106 -0.238 . . . . 0.0 110.919 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 49.03 71.64 1.53 Allowed Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 121.075 0.465 . . . . 0.0 110.086 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.58 148.13 82.96 Favored 'Trans proline' 0 C--N 1.295 -2.244 0 C-N-CA 122.819 2.346 . . . . 0.0 112.15 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.39 144.77 32.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.925 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 61' ' ' LEU . 0.6 OUTLIER -100.46 126.09 46.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.094 0.473 . . . . 0.0 111.104 -179.705 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 92' ' ' LEU . 4.6 mp -87.95 164.15 34.96 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.988 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -70.59 -6.77 19.78 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 C-N-CA 122.784 2.323 . . . . 0.0 112.025 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.8 p -94.56 2.52 55.66 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.509 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 74.45 41.59 0.35 Allowed 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.96 0.787 . . . . 0.0 111.074 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.432 ' NE2' HG11 ' A' ' 119' ' ' VAL . 33.6 m170 -134.62 118.15 16.89 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.031 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.46 135.55 33.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.242 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.701 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -149.89 167.46 26.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.512 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.3 m -71.6 135.49 46.99 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.955 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.4 t -51.63 -44.08 62.82 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.491 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.06 92.78 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.589 -0.445 . . . . 0.0 109.946 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 89.6 m -68.29 -33.53 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.698 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.701 HD21 ' HB3' ' A' ' 87' ' ' ALA . 88.7 mt -65.14 -35.43 81.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.486 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -44.29 -64.98 1.82 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.12 -20.74 71.85 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.633 2.222 . . . . 0.0 112.137 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.99 -38.29 85.49 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.032 0.444 . . . . 0.0 109.899 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.88 122.31 84.47 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.368 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.02 141.72 56.06 Favored 'Trans proline' 0 N--CA 1.502 1.987 0 C-N-CA 122.423 2.082 . . . . 0.0 112.41 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -143.07 -80.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 178.3 32.3 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.491 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.43 -41.29 96.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.663 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -126.32 -30.07 2.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.662 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 80.7 p -71.32 157.22 38.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.583 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.0 t -62.79 -43.78 97.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.625 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 138.84 -138.64 9.56 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 55.69 43.71 27.58 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.836 0.35 . . . . 0.0 110.628 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -78.68 179.73 52.13 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.32 -56.47 0.56 Allowed Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.25 94.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.353 . . . . 0.0 110.408 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -144.16 101.64 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.563 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 90.36 169.69 43.28 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.6 t0 64.5 77.23 0.32 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.737 0.303 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.55 -15.9 45.15 Favored Glycine 0 N--CA 1.452 -0.281 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 -179.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 80.9 p -115.58 -121.14 0.3 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.666 -0.267 . . . . 0.0 110.998 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.403 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.1 m -61.8 143.67 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 120.871 0.367 . . . . 0.0 110.052 -179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 69.5 t -110.99 137.32 43.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.479 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.72 113.44 19.7 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.608 0.718 . . . . 0.0 111.035 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 121' ' ' LYS . 42.7 t -104.11 133.78 20.05 Favored Pre-proline 0 C--N 1.312 -1.042 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.464 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.29 -10.45 8.51 Favored 'Trans proline' 0 C--N 1.301 -1.961 0 C-N-CA 121.682 1.588 . . . . 0.0 113.433 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 85' ' ' HIS . 38.9 t -94.81 -61.82 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.939 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 13.0 p -98.12 -29.5 13.2 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 110.95 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.0 mptt 58.01 28.99 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -161.42 137.29 7.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.717 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -143.85 154.38 43.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.732 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 5.6 t -83.76 -50.05 8.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -139.25 176.98 8.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.869 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.99 45.23 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.735 0.778 . . . . 0.0 111.599 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -86.53 -19.58 29.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.414 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.59 22.63 13.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.999 0.428 . . . . 0.0 110.908 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 25.2 pt -63.71 -170.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.5 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -40.69 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 O-C-N 123.895 0.747 . . . . 0.0 110.66 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 175.38 -31.74 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 124.186 0.929 . . . . 0.0 110.79 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -84.96 71.05 10.97 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.126 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -92.66 31.14 1.4 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.938 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.38 -37.26 80.19 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.425 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 36.5 tpp -82.55 109.33 16.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.799 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.1 mtm180 -152.78 82.97 1.22 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.802 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -119.97 11.39 11.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.019 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 15.5 m -62.47 141.07 58.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.739 0.304 . . . . 0.0 110.241 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 177.52 -165.94 36.02 Favored Glycine 0 CA--C 1.522 0.49 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 51.2 m 57.91 26.0 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.647 0.261 . . . . 0.0 110.336 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -128.65 131.19 48.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.32 150.98 31.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.799 0.333 . . . . 0.0 110.707 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -152.87 155.08 36.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.607 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 80.8 p -74.5 162.67 28.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.537 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 . . . . . 0 C--O 1.219 -0.519 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.575 -179.89 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.658 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.69 149.68 46.92 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 52.28 95.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.105 0.478 . . . . 0.0 110.835 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -88.22 30.66 0.85 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.432 0.634 . . . . 0.0 110.669 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.633 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.12 -12.47 12.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.51 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.43 HD23 ' HG3' ' A' ' 63' ' ' GLU . 39.5 mt -48.5 -23.76 1.08 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.334 179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.05 -42.65 90.77 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.475 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.9 mt -104.17 -39.98 6.32 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.785 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.2 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.633 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.6 OUTLIER 164.94 -79.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 O-C-N 124.114 0.884 . . . . 0.0 111.045 178.995 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -108.03 166.92 10.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.263 0.554 . . . . 0.0 110.468 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.426 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 10.0 t -77.37 135.66 38.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.309 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.26 -38.22 94.87 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.492 -0.385 . . . . 0.0 112.779 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.432 HG22 ' HG3' ' A' ' 118' ' ' PRO . 72.4 t -61.41 -42.54 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.14 -16.33 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 111.074 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.28 28.8 15.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.548 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -115.6 145.28 42.83 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.915 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -52.71 149.24 6.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.447 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.71 103.19 5.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.812 -178.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -71.38 157.72 89.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.385 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -37.14 95.65 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 121.616 1.544 . . . . 0.0 110.785 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.18 0.7 55.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.209 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -67.33 -24.76 65.77 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 111.332 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.439 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 87.6 tt0 53.72 66.28 4.67 Favored Pre-proline 0 N--CA 1.438 -1.042 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.418 -177.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.9 Cg_exo -62.0 146.2 96.38 Favored 'Trans proline' 0 C--N 1.302 -1.887 0 C-N-CA 122.458 2.105 . . . . 0.0 111.906 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.436 ' CB ' HD22 ' A' ' 92' ' ' LEU . 95.9 mtt180 -138.82 142.67 38.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.541 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.6 tp -99.82 126.55 45.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.307 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.522 HD23 ' OE1' ' A' ' 123' ' ' GLN . 1.9 mp -83.45 165.59 39.46 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.884 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -64.74 -14.42 44.7 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 123.205 2.604 . . . . 0.0 112.502 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -92.15 1.04 57.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.15 46.72 0.09 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.04 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -131.11 119.32 21.77 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.487 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -87.1 132.53 33.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.995 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.616 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -147.25 162.37 39.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.4 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.7 m -59.52 147.56 36.41 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.27 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -60.42 -44.28 95.91 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.344 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.47 -40.63 97.28 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.901 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.9 m -67.64 -34.12 76.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.064 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.616 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -63.86 -36.99 85.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.155 -179.129 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.61 -59.99 7.34 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.327 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -64.0 -16.42 54.8 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.43 2.087 . . . . 0.0 112.139 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.34 -37.58 81.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.008 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.36 126.26 72.15 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.606 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.32 144.06 92.16 Favored 'Trans proline' 0 N--CA 1.501 1.961 0 C-N-CA 122.006 1.804 . . . . 0.0 112.414 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -147.98 139.15 23.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.718 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -159.14 140.07 12.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.582 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.08 -40.93 99.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -143.92 109.95 5.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 31.7 t -85.34 125.99 33.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.561 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 96.3 p -63.34 -26.8 68.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.474 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 62.48 -147.09 49.72 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 52.5 t0 51.57 44.2 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.726 0.298 . . . . 0.0 110.618 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 175.33 -179.24 46.69 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -121.23 -156.84 9.9 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.39 39.93 6.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.874 0.369 . . . . 0.0 110.737 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.45 148.29 29.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.604 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -115.06 -115.19 3.02 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.172 -1.171 . . . . 0.0 110.172 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.5 t0 75.47 81.34 0.1 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.051 0.453 . . . . 0.0 111.459 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.75 -17.34 45.97 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.26 -123.18 0.29 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.1 m -62.05 148.08 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-O 121.416 0.627 . . . . 0.0 110.715 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 88.3 t -107.57 141.52 22.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.205 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.34 135.08 34.04 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.971 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 42.0 t -122.82 134.25 24.92 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.369 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.432 ' HG3' HG22 ' A' ' 67' ' ' VAL . 34.5 Cg_endo -64.91 -9.16 20.26 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 CA-C-N 120.431 1.19 . . . . 0.0 112.556 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 17.3 t -93.26 -61.27 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.326 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 29.1 p -99.51 -22.28 15.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.4 mptt 55.07 29.25 12.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.157 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -162.03 129.92 4.05 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.988 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.522 ' OE1' HD23 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -122.72 130.59 53.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.895 179.49 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 93.4 m -61.69 -47.7 84.1 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.772 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -145.2 176.8 9.26 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.465 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.423 ' HA ' HG23 ' A' ' 129' ' ' ILE . 0.1 OUTLIER -109.3 32.18 5.17 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.017 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -86.2 -31.17 21.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.628 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -103.86 22.49 14.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.884 0.373 . . . . 0.0 111.668 -179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.423 HG23 ' HA ' ' A' ' 126' ' ' SER . 41.3 pt -68.19 -169.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.775 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.424 HG13 HD23 ' A' ' 92' ' ' LEU . 2.2 m -36.49 104.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 O-C-N 124.045 0.84 . . . . 0.0 110.828 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 170.79 -32.75 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 124.027 0.829 . . . . 0.0 110.362 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -83.45 64.36 7.81 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.795 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -97.81 29.25 3.47 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.414 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.4 -48.01 83.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.628 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.7 tpt -77.31 119.83 21.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.23 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.8 mtm180 -123.8 35.82 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.035 0.445 . . . . 0.0 110.806 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.47 141.89 58.18 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.757 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.9 p -174.65 -30.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.132 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 178.14 -151.31 10.52 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 96.4 p -62.28 -20.39 64.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.01 0.434 . . . . 0.0 110.575 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.21 136.44 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.253 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 52.81 21.63 2.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.953 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -71.56 144.42 49.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.784 0.326 . . . . 0.0 110.796 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -74.51 -30.14 61.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.518 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.7 t0 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.42 -179.977 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.623 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 74.3 25.05 71.7 Favored Glycine 0 CA--C 1.52 0.402 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.435 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . 62.31 112.94 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.093 0.473 . . . . 0.0 110.387 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.705 ' OE1' ' HB2' ' A' ' 142' ' ' ALA . 49.7 mp0 -84.0 32.42 0.48 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.475 0.655 . . . . 0.0 110.823 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.664 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.87 -11.65 13.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.405 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.404 HD23 ' HG3' ' A' ' 63' ' ' GLU . 55.5 mt -48.36 -22.36 0.68 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.612 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -58.44 -42.37 87.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.068 0.461 . . . . 0.0 110.206 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.5 mt -104.31 -39.59 6.42 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.72 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.26 -84.1 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.664 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.1 mt-10 166.52 -80.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.978 0.799 . . . . 0.0 110.966 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.99 170.14 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.104 0.478 . . . . 0.0 110.157 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.461 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 23.8 t -87.59 141.87 28.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.335 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.29 -39.21 92.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.653 -0.308 . . . . 0.0 112.38 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 74.9 t -61.52 -37.91 78.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -24.67 10.89 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.177 0.513 . . . . 0.0 111.116 -178.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 65.43 33.0 9.17 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.836 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -128.81 149.08 50.89 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.78 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -52.6 147.94 7.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.904 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.456 HD13 ' HB3' ' A' ' 78' ' ' PRO . 73.6 mt -72.78 116.51 13.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.001 -178.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.95 161.8 72.32 Favored Pre-proline 0 N--CA 1.463 0.224 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.305 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.67 -40.26 74.95 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.083 1.856 . . . . 0.0 111.641 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -90.03 1.92 55.78 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.296 179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.29 -24.83 66.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.669 -178.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 52.48 70.56 1.82 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-O 121.351 0.596 . . . . 0.0 109.899 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.456 ' HB3' HD13 ' A' ' 72' ' ' LEU . 57.4 Cg_endo -70.11 153.57 67.18 Favored 'Trans proline' 0 C--N 1.294 -2.32 0 C-N-CA 122.843 2.362 . . . . 0.0 111.412 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.412 ' HD2' HG12 ' A' ' 130' ' ' VAL . 0.0 OUTLIER -148.6 174.62 11.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.506 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -126.06 141.07 52.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.986 0.422 . . . . 0.0 111.33 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.534 ' CD1' HD22 ' A' ' 92' ' ' LEU . 2.2 mp -101.17 165.6 13.88 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-O 121.136 0.493 . . . . 0.0 110.897 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.51 -16.45 54.69 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.318 2.679 . . . . 0.0 112.155 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 26.7 p -86.31 -6.09 59.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.317 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 78.14 48.01 0.05 OUTLIER 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.923 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -129.98 121.74 27.13 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.295 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.4 m -87.06 138.64 31.32 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.998 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.695 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -157.92 166.69 31.98 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.127 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.468 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.7 m -68.83 139.68 55.22 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 t -56.75 -42.84 80.02 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.298 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.38 -40.41 94.22 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 97.8 m -71.01 -22.14 62.2 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.235 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.695 HD21 ' HB3' ' A' ' 87' ' ' ALA . 84.3 mt -81.17 -20.72 40.63 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.525 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -59.84 -53.42 46.07 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 120.556 -0.831 . . . . 0.0 111.571 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.24 -19.31 33.85 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.641 2.227 . . . . 0.0 111.779 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.99 -38.19 78.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -94.13 147.56 33.61 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.992 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.16 -20.69 55.85 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.559 2.172 . . . . 0.0 112.562 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.18 -38.81 80.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 146.22 47.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.428 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.43 88.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.709 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -82.83 82.18 8.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.923 0.392 . . . . 0.0 110.333 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.6 p -155.92 166.08 34.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.52 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 91.2 p -132.63 155.1 49.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.456 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.98 99.45 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 53.0 t0 51.71 46.14 27.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.504 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 76.62 -164.38 53.22 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -97.84 117.43 5.81 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -156.69 153.12 27.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.737 0.303 . . . . 0.0 110.628 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.63 142.5 58.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.699 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 167.23 -175.42 42.36 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.9 t0 69.22 76.75 0.23 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.08 -17.68 37.54 Favored Glycine 0 N--CA 1.452 -0.236 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 82.2 p -115.11 -120.92 0.3 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.568 -0.316 . . . . 0.0 110.17 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.29 142.83 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 121.017 0.437 . . . . 0.0 110.311 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.3 t -107.17 129.84 60.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.717 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -74.29 123.76 25.17 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.964 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 121' ' ' LYS . 23.4 t -106.76 129.65 24.09 Favored Pre-proline 0 C--O 1.199 -1.57 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.874 -179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -61.36 -10.22 15.28 Favored 'Trans proline' 0 C--N 1.295 -2.273 0 CA-C-N 121.715 1.648 . . . . 0.0 113.34 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.7 t -85.81 -43.73 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.394 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -120.21 -30.07 4.71 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.503 0.668 . . . . 0.0 110.307 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.9 OUTLIER 65.14 35.16 8.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.146 178.95 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -164.3 123.12 1.87 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.32 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.13 159.64 23.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.344 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.2 m -87.59 -55.85 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.58 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -143.52 176.82 8.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 16.0 p -101.82 27.2 6.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.022 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -88.52 -28.83 20.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.382 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -112.72 22.68 14.27 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.654 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.1 pt -86.04 -169.95 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.966 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.412 HG12 ' HD2' ' A' ' 79' ' ' ARG . 2.2 m -43.27 106.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 O-C-N 123.721 0.638 . . . . 0.0 110.248 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.64 -22.41 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 124.408 1.067 . . . . 0.0 110.864 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -97.56 22.62 8.69 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.983 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -41.2 139.29 1.0 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.416 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -161.52 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.088 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.08 144.02 50.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.947 0.403 . . . . 0.0 110.059 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -82.66 68.45 9.13 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.458 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.58 134.27 54.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.922 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 12.6 p 177.48 145.42 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.624 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 53.81 -129.41 41.73 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 95.9 p -93.69 -1.21 55.5 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.925 -0.637 . . . . 0.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -83.54 127.36 33.67 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.824 0.345 . . . . 0.0 110.65 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.705 ' HB2' ' OE1' ' A' ' 57' ' ' GLU . . . -155.43 139.95 16.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.292 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.31 96.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.57 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 65.6 p -78.68 163.98 24.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.522 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.2 t0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 118.11 -0.947 . . . . 0.0 110.573 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.98 -96.61 0.12 Allowed Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.636 ' HB3' ' HE ' ' A' ' 71' ' ' ARG . . . -59.78 119.01 6.86 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -95.26 20.5 9.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.397 0.618 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.0 -12.32 18.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.63 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.416 HD23 ' HG3' ' A' ' 63' ' ' GLU . 36.6 mt -49.01 -23.67 1.24 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.165 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -59.68 -43.5 93.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.691 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 80' ' ' LEU . 57.5 mt -104.47 -41.56 5.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.599 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.74 -89.93 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.631 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 165.24 -79.03 0.0 OUTLIER 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.5 0.72 . . . . 0.0 110.836 179.569 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -99.87 167.22 10.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.117 0.484 . . . . 0.0 110.116 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 27.2 t -82.05 136.72 35.19 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.516 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -71.46 -30.07 67.26 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.72 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.1 t -61.53 -39.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.23 -17.39 11.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 0.0 111.22 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.75 38.43 9.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.791 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -129.3 144.9 51.4 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.043 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.636 ' HE ' ' HB3' ' A' ' 56' ' ' ALA . 42.4 ttt180 -50.71 148.89 3.64 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.426 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.4 HD13 ' HB3' ' A' ' 78' ' ' PRO . 80.0 mt -75.47 120.24 20.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.466 -178.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -82.76 163.03 53.4 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.204 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.08 -34.09 47.93 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 121.908 1.738 . . . . 0.0 111.579 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -92.68 -2.03 56.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.389 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -66.89 -23.88 66.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.233 0.54 . . . . 0.0 111.514 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 54.72 70.34 1.7 Allowed Pre-proline 0 N--CA 1.446 -0.636 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.877 -178.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.4 ' HB3' HD13 ' A' ' 72' ' ' LEU . 40.3 Cg_endo -67.49 149.26 80.04 Favored 'Trans proline' 0 C--N 1.3 -1.986 0 C-N-CA 123.148 2.565 . . . . 0.0 111.913 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -141.7 162.29 35.85 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.131 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 61' ' ' LEU . 57.6 tp -115.44 127.69 55.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.903 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.75 164.55 36.62 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.842 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 -6.42 19.04 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.92 2.413 . . . . 0.0 112.334 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.6 p -95.38 3.95 53.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 75.22 41.21 0.3 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.521 0.677 . . . . 0.0 111.346 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.495 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.3 m170 -134.55 119.75 18.82 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.732 178.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.9 m -86.64 139.63 30.61 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.911 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.648 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -149.95 166.86 28.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 -179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -68.2 151.84 46.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.697 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.4 t -60.35 -47.15 87.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.337 0.589 . . . . 0.0 110.22 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.34 -40.02 96.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.135 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.81 -27.1 64.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.998 0.427 . . . . 0.0 109.85 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.648 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -68.34 -37.87 80.94 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.824 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.12 -61.31 5.47 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.21 -29.51 76.02 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.961 2.441 . . . . 0.0 111.682 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.45 -40.5 91.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.172 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -87.67 117.99 69.21 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.143 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.52 137.66 73.2 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 121.941 1.761 . . . . 0.0 112.21 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.93 -27.18 14.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.576 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -159.07 156.92 30.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.05 82.77 3.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.637 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -62.62 -42.22 99.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.5 m -71.13 148.68 47.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.4 t -133.77 128.2 34.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.446 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.92 4.37 89.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -102.81 149.56 24.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.328 . . . . 0.0 110.645 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.97 152.37 51.0 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.67 18.2 79.2 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.09 -38.89 87.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.751 0.31 . . . . 0.0 110.6 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -58.19 138.85 55.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.487 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 177.93 173.95 43.82 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.1 t0 68.24 82.53 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.534 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.93 -14.69 40.9 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.74 -121.44 0.3 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.341 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 123' ' ' GLN . 3.2 m -62.78 143.54 15.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 122.078 -0.389 . . . . 0.0 110.482 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 98.7 t -119.34 131.06 73.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.985 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.41 ' O ' ' HB1' ' A' ' 95' ' ' ALA . 0.4 OUTLIER -69.89 141.76 53.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.204 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.482 ' H ' ' HA ' ' A' ' 121' ' ' LYS . 19.2 t -139.94 132.77 15.04 Favored Pre-proline 0 N--CA 1.444 -0.733 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.484 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.406 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 31.1 Cg_endo -63.06 -9.59 17.58 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 121.384 1.389 . . . . 0.0 112.798 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.495 HG11 ' NE2' ' A' ' 85' ' ' HIS . 6.5 t -94.56 -61.04 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.4 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 11.0 p -99.05 -27.13 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.782 0.325 . . . . 0.0 110.983 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.482 ' HA ' ' H ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER 57.5 31.7 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 179.336 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -168.25 136.69 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.451 ' O ' HG12 ' A' ' 114' ' ' VAL . 2.6 mm-40 -142.3 123.53 14.68 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.52 179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 91.8 m -61.79 -44.33 97.09 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -144.12 177.18 8.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.635 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.459 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -121.0 63.75 0.87 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.273 0.558 . . . . 0.0 111.582 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -89.14 -30.0 18.93 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.507 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.2 23.14 13.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 111.535 -178.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.459 HD13 ' HB2' ' A' ' 126' ' ' SER . 10.6 pt -64.69 -169.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.35 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.643 HG13 HD23 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -35.59 104.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 O-C-N 123.924 0.765 . . . . 0.0 110.578 -179.674 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 172.54 -34.2 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 124.135 0.897 . . . . 0.0 110.599 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -83.99 70.18 10.42 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.808 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -97.39 33.0 2.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.843 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -58.65 -48.24 81.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.9 mmt -70.1 143.68 52.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.73 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -160.43 31.06 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.39 0.614 . . . . 0.0 110.501 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -98.0 162.06 13.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.523 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 90.9 p -161.35 170.67 19.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 -179.156 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -60.18 -39.59 96.12 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 8.7 m -90.97 -158.3 0.55 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.6 tttt 65.53 108.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.618 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.23 36.85 28.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.405 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.89 150.03 33.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.571 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 93.7 m -71.13 130.9 42.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.789 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 93.92 112.74 2.34 Favored Glycine 0 N--CA 1.46 0.233 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -156.65 154.04 29.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.977 0.418 . . . . 0.0 110.308 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -90.12 31.16 1.01 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.827 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.638 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -63.03 -12.34 25.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.443 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.458 HD23 ' HG3' ' A' ' 63' ' ' GLU . 38.6 mt -49.41 -23.16 1.38 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.989 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -59.24 -44.43 92.35 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.835 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.9 -41.78 5.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -162.81 -87.55 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.638 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 168.36 -80.06 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.765 0.666 . . . . 0.0 111.269 179.788 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -113.79 164.05 14.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.163 0.506 . . . . 0.0 110.149 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.451 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 13.6 t -79.41 138.58 37.68 Favored 'General case' 0 C--O 1.211 -0.929 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.851 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.67 -35.82 81.45 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.741 -0.266 . . . . 0.0 112.747 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.2 t -59.09 -43.8 90.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 9.9 p -109.5 -18.43 13.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.837 0.351 . . . . 0.0 111.587 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 64.93 30.19 12.05 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.933 178.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -119.7 148.58 43.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.282 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -54.27 150.83 8.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.626 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 78' ' ' PRO . 57.7 mt -80.48 105.54 11.81 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.696 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.445 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 2.9 ptm180 -80.83 167.13 34.68 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.165 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -52.29 -46.83 30.29 Favored 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 122.607 2.204 . . . . 0.0 113.033 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.7 mt-10 -82.8 0.07 45.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.204 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.21 -24.46 64.94 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 47.14 73.09 1.06 Allowed Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.283 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.494 ' HB3' HD13 ' A' ' 72' ' ' LEU . 46.9 Cg_endo -68.36 147.9 72.69 Favored 'Trans proline' 0 C--N 1.299 -2.063 0 C-N-CA 122.711 2.274 . . . . 0.0 112.008 -179.05 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.85 156.08 45.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.792 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.4 tp -106.88 127.33 53.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.27 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.575 HD11 HD22 ' A' ' 92' ' ' LEU . 2.5 mp -86.39 167.06 24.8 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.023 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.69 -20.32 64.86 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.984 2.456 . . . . 0.0 112.224 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 7.2 p -89.64 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.63 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 73.02 50.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.994 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.509 ' CE1' HG11 ' A' ' 119' ' ' VAL . 51.9 m170 -128.97 124.4 34.92 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.868 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -85.79 132.89 34.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.767 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -151.16 165.54 33.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.043 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.437 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -71.11 136.75 48.36 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.822 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.8 t -53.95 -43.29 69.74 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.031 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.28 -39.16 89.39 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.3 m -68.09 -33.65 74.93 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.241 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.767 HD21 ' HB3' ' A' ' 87' ' ' ALA . 84.9 mt -67.19 -28.76 68.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.178 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.402 ' N ' ' HD2' ' A' ' 94' ' ' PRO . . . -53.57 -60.51 8.16 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.392 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 93' ' ' GLY . 30.8 Cg_endo -64.56 -10.34 24.02 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.633 2.222 . . . . 0.0 112.624 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.51 -30.17 66.85 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.789 0.328 . . . . 0.0 110.219 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.437 ' HB2' HG13 ' A' ' 115' ' ' VAL . . . -117.3 148.73 43.22 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.449 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -76.09 152.16 35.53 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.517 2.145 . . . . 0.0 112.466 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -156.11 146.13 21.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.482 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 48.16 42.85 18.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.612 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -117.38 -165.45 1.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.637 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -59.85 -39.36 84.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.479 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.9 t -60.67 139.59 57.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.1 t -144.19 143.53 31.12 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.336 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -61.26 -43.37 99.47 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.68 -41.97 99.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.983 0.421 . . . . 0.0 110.449 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.07 -38.22 96.22 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.68 14.81 39.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 110.674 -0.971 . . . . 0.0 110.674 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -67.92 142.74 55.94 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-O 120.833 0.349 . . . . 0.0 110.763 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.22 148.58 48.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 91.26 168.61 41.68 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.1 t0 61.16 76.69 0.36 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.831 0.348 . . . . 0.0 110.915 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.77 -17.52 35.76 Favored Glycine 0 CA--C 1.519 0.298 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 77.3 p -115.83 -120.6 0.3 Allowed 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 123' ' ' GLN . 78.4 t -65.0 137.2 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 CA-C-O 120.964 0.411 . . . . 0.0 110.525 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.533 HG21 HG21 ' A' ' 129' ' ' ILE . 96.8 t -106.48 142.41 19.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.408 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -84.87 114.73 22.32 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.478 0.656 . . . . 0.0 111.009 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.4 t -104.56 132.97 20.44 Favored Pre-proline 0 C--O 1.206 -1.229 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.216 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.11 -16.3 26.72 Favored 'Trans proline' 0 C--N 1.297 -2.15 0 C-N-CA 121.216 1.278 . . . . 0.0 112.626 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.509 HG11 ' CE1' ' A' ' 85' ' ' HIS . 16.4 t -96.39 -51.72 10.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.35 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -31.7 11.67 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.953 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 117' ' ' CYS . 3.0 mptt 59.46 22.82 11.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.12 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -172.8 97.86 0.13 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.233 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.588 ' O ' HG13 ' A' ' 114' ' ' VAL . 28.6 mm100 -89.52 145.81 25.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 0.0 110.374 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 88.5 m -61.03 -46.52 90.41 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.498 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -145.93 178.0 8.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.918 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.543 ' HA ' HG23 ' A' ' 129' ' ' ILE . 1.2 p -116.28 36.85 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.48 0.657 . . . . 0.0 111.64 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -89.65 -31.22 17.62 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.623 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -108.86 20.75 18.1 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.656 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.543 HG23 ' HA ' ' A' ' 126' ' ' SER . 24.2 pt -71.25 -169.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.524 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.441 HG22 ' O ' ' A' ' 130' ' ' VAL . 0.2 OUTLIER -37.68 108.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 O-C-N 123.8 0.688 . . . . 0.0 110.12 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 164.74 -31.57 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 124.818 1.324 . . . . 0.0 111.321 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -93.47 85.87 5.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.958 -0.697 . . . . 0.0 111.29 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -93.19 137.38 32.57 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.909 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -94.85 -75.78 0.51 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.815 0.34 . . . . 0.0 110.51 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 28.1 ttt -146.02 142.54 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -83.93 64.98 8.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.355 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.64 122.34 13.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.173 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 170.42 -66.66 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.792 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -60.17 -39.5 95.97 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 36.1 t -57.81 -25.69 60.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.029 0.442 . . . . 0.0 110.435 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -58.7 -41.18 85.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.241 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -126.63 39.65 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.923 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.93 -39.19 88.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.46 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.8 m -60.9 -44.39 97.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 37.1 t0 . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.677 179.758 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -107.15 -118.07 4.3 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . -60.89 141.82 56.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.78 0.324 . . . . 0.0 110.602 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -90.8 28.81 1.45 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.724 0.774 . . . . 0.0 110.681 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.659 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.55 -11.99 19.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.409 HD23 ' HG3' ' A' ' 63' ' ' GLU . 36.5 mt -48.58 -23.59 1.05 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.277 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.97 -43.35 91.32 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.0 110.594 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.442 HD11 ' CG ' ' A' ' 134' ' ' PHE . 69.9 mt -104.6 -41.06 5.8 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.022 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.23 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.659 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 165.45 -78.13 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.117 0 O-C-N 123.953 0.783 . . . . 0.0 110.75 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.5 p-80 -107.88 165.98 11.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 110.824 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.543 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 13.3 t -81.12 137.14 35.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.563 -179.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.81 -37.98 93.92 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.676 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.488 HG22 ' HG3' ' A' ' 118' ' ' PRO . 73.1 t -59.93 -40.81 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 8.4 p -112.64 -18.63 12.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.943 0.401 . . . . 0.0 111.109 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.32 39.62 9.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.309 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.49 146.79 50.71 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.216 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -55.99 144.42 28.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.633 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.521 HD13 ' HB3' ' A' ' 78' ' ' PRO . 80.7 mt -71.19 105.85 3.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.447 -179.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.463 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 3.5 ptm180 -79.93 165.8 44.84 Favored Pre-proline 0 C--N 1.333 -0.133 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.554 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -53.05 -43.53 56.24 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 122.432 2.088 . . . . 0.0 113.31 -177.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.463 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.2 mt-10 -88.15 2.26 52.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -66.01 -24.98 66.87 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.983 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 50.56 69.0 2.87 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 109.791 -179.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.521 ' HB3' HD13 ' A' ' 72' ' ' LEU . 51.2 Cg_endo -68.9 150.81 73.72 Favored 'Trans proline' 0 C--N 1.293 -2.386 0 C-N-CA 122.628 2.219 . . . . 0.0 111.078 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.32 165.49 29.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.673 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp -114.35 130.19 56.67 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.914 0.388 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.516 HD11 HD22 ' A' ' 92' ' ' LEU . 3.7 mp -90.16 164.54 27.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.242 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.51 -6.2 18.6 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.043 2.495 . . . . 0.0 112.33 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.77 0.91 55.33 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.376 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 77.65 41.54 0.13 Allowed 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 123.825 0.703 . . . . 0.0 111.338 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.463 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.4 m170 -135.29 119.85 18.14 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.995 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -86.52 141.64 28.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.9 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.787 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -157.63 166.86 31.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.875 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' CYS . . . . . 0.47 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -65.77 137.05 56.99 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.9 t -56.72 -42.19 78.76 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.069 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.27 91.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 80.8 m -66.83 -36.25 81.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.204 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.787 HD21 ' HB3' ' A' ' 87' ' ' ALA . 82.0 mt -66.09 -30.55 71.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.27 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.95 -62.35 4.65 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.866 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.38 -17.29 59.37 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.131 1.887 . . . . 0.0 112.05 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.01 -37.28 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.328 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.16 122.31 85.13 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.152 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.17 141.71 79.59 Favored 'Trans proline' 0 N--CA 1.5 1.862 0 C-N-CA 121.969 1.78 . . . . 0.0 112.189 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -148.03 -64.54 0.26 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.663 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.9 92.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.63 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -118.61 149.33 41.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.334 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.34 -39.8 91.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.6 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.1 t 64.59 117.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.593 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 70.8 m -64.16 145.05 56.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.74 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -176.87 172.95 45.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -77.09 -1.57 29.78 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.34 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -91.9 61.96 2.63 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.476 -1.049 . . . . 0.0 110.476 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.0 24.98 76.16 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.09 23.67 14.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.302 . . . . 0.0 110.543 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 147.56 23.02 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.878 0.37 . . . . 0.0 110.538 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -116.04 -146.76 8.76 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.6 t0 73.03 81.65 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.783 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.31 -17.4 40.48 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 75.6 p -115.7 -122.16 0.29 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.9 m -63.3 142.91 16.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.807 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.535 HG23 ' OG ' ' A' ' 126' ' ' SER . 56.4 t -113.63 140.72 32.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.421 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -87.74 129.25 35.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.537 0.684 . . . . 0.0 109.913 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.0 t -116.12 131.41 23.78 Favored Pre-proline 0 C--O 1.195 -1.765 0 CA-C-N 114.805 -1.088 . . . . 0.0 108.226 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.488 ' HG3' HG22 ' A' ' 67' ' ' VAL . 23.9 Cg_endo -59.6 -11.5 14.44 Favored 'Trans proline' 0 C--N 1.295 -2.25 0 CA-C-N 121.502 1.572 . . . . 0.0 113.176 -178.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.463 HG11 ' NE2' ' A' ' 85' ' ' HIS . 21.4 t -84.01 -44.82 18.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.541 -0.463 . . . . 0.0 111.7 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.55 -30.69 5.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.02 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.2 OUTLIER 64.24 31.44 13.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.073 178.581 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -162.72 139.43 7.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.996 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -143.05 161.49 38.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.077 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 80.4 m -96.48 -43.16 7.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.998 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -142.34 175.05 10.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.251 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.535 ' OG ' HG23 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -125.06 42.71 3.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.336 0.588 . . . . 0.0 111.217 179.6 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -85.75 -15.45 42.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.031 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -114.33 22.48 13.69 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.6 pt -69.12 -173.65 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.774 0.321 . . . . 0.0 111.144 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.462 HG12 HD12 ' A' ' 92' ' ' LEU . 2.3 m -45.47 105.61 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.284 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.572 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 168.26 -32.16 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 124.152 0.908 . . . . 0.0 110.576 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -93.31 64.95 3.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.154 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -60.83 139.37 57.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.394 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' PHE . . . . . 0.442 ' CG ' HD11 ' A' ' 61' ' ' LEU . 80.7 t80 -93.56 -72.95 0.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.485 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.7 ttt -150.79 144.86 25.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.596 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -122.48 99.69 6.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -135.75 34.6 2.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.696 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 15.5 m -49.81 -73.34 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 59.18 17.15 36.74 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 85.7 p -88.6 -13.6 39.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.698 0.285 . . . . 0.0 111.294 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -73.43 130.24 39.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.431 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.18 125.43 38.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -59.93 -28.44 67.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.425 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.5 m -60.08 -42.11 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.6 p-10 . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.682 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.659 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 94.23 163.04 35.69 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -139.19 140.42 37.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.794 0.331 . . . . 0.0 110.366 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.1 mp0 -94.41 30.26 2.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.77 0.795 . . . . 0.0 110.148 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.8 -11.98 15.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.447 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.425 HD23 ' HG3' ' A' ' 63' ' ' GLU . 43.8 mt -47.51 -24.07 0.77 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.309 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -58.98 -41.74 88.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.331 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 mp -104.42 -40.91 5.9 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.934 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.55 -85.49 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 164.7 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 O-C-N 124.136 0.898 . . . . 0.0 110.905 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.88 162.37 14.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.306 0.574 . . . . 0.0 110.699 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 30.5 t -73.31 134.9 44.31 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.544 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.5 -30.07 71.28 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.775 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.1 t -64.11 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.06 -15.47 11.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 110.972 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.33 41.09 8.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.254 0.55 . . . . 0.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -126.19 144.97 50.57 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.196 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -52.57 151.98 3.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.64 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.3 mt -85.87 102.28 13.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.017 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -75.9 160.22 79.14 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.854 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -57.59 -33.16 96.15 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.161 1.907 . . . . 0.0 111.319 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -89.03 -8.17 54.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.449 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -67.78 -24.33 65.31 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.911 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 51.09 73.6 0.95 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.479 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.04 149.43 71.49 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.706 2.27 . . . . 0.0 111.739 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.423 ' CZ ' HG23 ' A' ' 130' ' ' VAL . 96.0 mtt180 -141.54 141.58 33.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.306 -178.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.8 tp -92.65 129.22 38.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.47 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -85.59 165.37 35.81 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.27 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -62.68 -18.33 63.5 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.175 2.583 . . . . 0.0 112.34 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.64 2.7 55.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.103 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.7 47.68 0.12 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.206 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -133.91 124.75 26.94 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.472 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.9 m -85.06 138.49 32.4 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.987 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.594 ' HB3' HD12 ' A' ' 92' ' ' LEU . . . -147.98 160.88 42.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.314 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 6.3 m -62.67 151.83 37.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.5 t -58.74 -47.56 84.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.985 0.422 . . . . 0.0 110.582 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.79 -42.44 95.05 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.817 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.8 m -67.07 -23.72 65.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.204 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.594 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -64.56 -32.11 73.62 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.126 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.49 -65.14 3.44 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 95' ' ' ALA . 22.0 Cg_exo -64.37 110.5 1.4 Allowed 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.689 2.26 . . . . 0.0 111.492 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.669 ' HB1' ' O ' ' A' ' 116' ' ' ASP . . . 169.56 -71.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.629 0.581 . . . . 0.0 110.057 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.742 ' HB2' HG22 ' A' ' 115' ' ' VAL . . . -60.06 -60.18 11.44 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.919 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.518 ' CD ' ' HB3' ' A' ' 96' ' ' ALA . 8.3 Cg_endo -48.7 131.3 24.11 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.491 2.127 . . . . 0.0 112.442 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 48.86 38.47 12.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.621 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 96' ' ' ALA . . . -64.99 134.09 53.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.248 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . 53.08 22.69 2.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.312 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.426 ' ND2' ' O ' ' A' ' 106' ' ' GLY . 21.5 m120 -107.83 108.59 19.85 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.589 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.0 m -63.63 -40.39 96.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 91.5 p -62.39 -38.05 88.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -12.2 66.43 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -64.04 -39.58 94.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.79 0.328 . . . . 0.0 110.547 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.426 ' O ' ' ND2' ' A' ' 101' ' ' ASN . . . 148.72 -168.41 29.27 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.39 172.59 41.71 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.45 -39.91 92.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.718 0.294 . . . . 0.0 110.709 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -112.5 143.58 43.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.681 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 101.23 174.86 28.84 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.37 73.55 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.026 0.441 . . . . 0.0 110.628 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 102.98 -13.44 56.06 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.0 p -114.68 -118.94 0.31 Allowed 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.428 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.7 m -61.3 141.83 16.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.742 HG22 ' HB2' ' A' ' 96' ' ' ALA . 58.5 t -107.74 134.01 50.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.117 -178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.669 ' O ' ' HB1' ' A' ' 95' ' ' ALA . 15.8 t70 -81.37 108.66 15.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.968 0.889 . . . . 0.0 110.54 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 121' ' ' LYS . 36.6 t -95.83 131.76 28.55 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.787 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.97 -12.07 14.21 Favored 'Trans proline' 0 C--N 1.297 -2.147 0 C-N-CA 121.003 1.136 . . . . 0.0 112.771 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.44 -61.58 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.504 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 9.3 p -98.7 -25.35 14.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.953 0.406 . . . . 0.0 110.85 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.7 mptt 55.74 32.66 19.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -165.27 137.47 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.03 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -144.6 142.08 29.9 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 98.7 m -70.86 -44.63 66.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.011 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -145.49 178.07 8.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.711 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.54 48.86 1.52 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.481 0.658 . . . . 0.0 111.516 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.01 -29.7 21.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.282 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -103.86 20.49 18.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.904 0.383 . . . . 0.0 111.392 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.6 pt -62.9 -168.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.483 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -35.31 116.5 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 O-C-N 124.054 0.846 . . . . 0.0 110.437 -179.756 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 161.63 -32.52 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.465 0 O-C-N 124.986 1.429 . . . . 0.0 110.013 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -85.59 60.02 5.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.228 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -97.25 28.59 3.56 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.473 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -59.48 -48.04 83.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.6 mmt -78.83 121.1 24.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.237 0.541 . . . . 0.0 110.844 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -153.35 104.34 2.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.22 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -108.4 -80.93 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.133 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 18.6 p 42.93 80.48 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.339 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 67.03 23.88 73.0 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 54.1 m 56.94 33.6 23.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.732 0.301 . . . . 0.0 110.364 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm -94.98 87.39 4.92 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -158.4 156.66 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.416 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -99.35 126.96 45.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.605 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 64.2 p -86.38 -15.16 41.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.548 179.936 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.703 0 N-CA-C 110.784 -0.927 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' O ' ' HB3' ' A' ' 56' ' ' ALA . . . 72.91 25.14 74.58 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 55' ' ' GLY . . . 65.63 117.57 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.065 0.46 . . . . 0.0 109.799 -179.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.96 19.82 1.31 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.093 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.652 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -59.81 -12.67 7.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.632 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.414 HD23 ' HG3' ' A' ' 63' ' ' GLU . 44.3 mt -47.93 -24.02 0.93 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.461 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -59.39 -41.58 89.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.067 0.46 . . . . 0.0 110.382 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -104.0 -40.43 6.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.869 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.35 -86.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.652 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.5 mt-10 164.29 -78.95 0.0 OUTLIER 'General case' 0 CA--C 1.527 0.064 0 O-C-N 124.037 0.835 . . . . 0.0 110.823 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -106.17 163.09 13.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.315 0.579 . . . . 0.0 110.72 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -76.73 135.1 39.02 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.216 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.86 -37.94 94.93 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.634 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.494 HG22 ' HG2' ' A' ' 118' ' ' PRO . 78.2 t -60.41 -40.32 83.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -176.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 7.7 p -113.07 -17.79 12.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.956 0.408 . . . . 0.0 110.939 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.23 41.31 8.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.368 179.09 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -129.76 147.8 51.57 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.161 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.8 tpp85 -54.26 144.74 19.39 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.941 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.9 mt -75.53 102.85 5.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.24 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -78.83 164.28 56.13 Favored Pre-proline 0 C--N 1.331 -0.207 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.86 -48.28 17.23 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 C-N-CA 121.44 1.427 . . . . 0.0 112.668 -178.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -72.2 -4.87 31.89 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.968 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -67.34 -25.14 65.85 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.777 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 51.78 72.11 1.3 Allowed Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.255 -178.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.81 148.2 76.57 Favored 'Trans proline' 0 C--N 1.297 -2.157 0 C-N-CA 122.711 2.274 . . . . 0.0 112.102 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -139.52 160.89 38.8 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.161 -178.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.2 tp -115.31 127.85 55.71 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.013 0.435 . . . . 0.0 111.019 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.3 mp -87.39 164.59 34.75 Favored Pre-proline 0 N--CA 1.467 0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.097 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.57 -6.67 19.63 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 123.061 2.508 . . . . 0.0 112.408 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -94.5 0.1 55.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 78.33 41.67 0.11 Allowed 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.947 0.779 . . . . 0.0 111.221 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.465 ' CD2' HG11 ' A' ' 119' ' ' VAL . 33.8 m170 -134.79 123.94 24.36 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.515 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.5 m -86.83 143.49 27.45 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.828 -0.749 . . . . 0.0 109.719 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.64 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -150.49 164.48 35.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.992 -179.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 21.1 m -66.85 151.08 48.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.181 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.3 p -61.8 -42.24 98.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.616 0.722 . . . . 0.0 109.878 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.46 95.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.268 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.92 -31.85 69.83 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.775 0.798 . . . . 0.0 109.963 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.64 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -63.46 -37.14 86.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.429 -179.724 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.64 -62.31 4.94 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 120.508 -0.853 . . . . 0.0 111.203 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.21 -22.6 66.89 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 122.08 1.854 . . . . 0.0 111.467 179.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.65 -38.9 82.67 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.934 179.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.43 118.33 66.29 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.962 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -55.82 141.5 85.04 Favored 'Trans proline' 0 N--CA 1.499 1.828 0 C-N-CA 121.966 1.777 . . . . 0.0 112.381 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -90.64 -25.01 20.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.68 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.54 139.54 33.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.445 ' HB2' ' HB3' ' A' ' 111' ' ' ASP . . . -141.35 137.92 32.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 0.0 110.756 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.5 t-20 -62.35 -40.37 96.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.615 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.3 t 68.04 45.62 1.3 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.236 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.4 t -150.85 150.14 30.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.411 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.77 17.18 75.78 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.484 -0.646 . . . . 0.0 111.484 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 44.5 t0 55.62 60.04 3.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.652 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 95.69 16.42 39.46 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.5 -0.21 71.99 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.601 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.559 ' O ' HG21 ' A' ' 113' ' ' THR . . . -58.35 139.04 56.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.975 0.388 . . . . 0.0 110.483 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.2 -40.03 94.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.76 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -140.39 173.19 23.18 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.445 ' HB3' ' HB2' ' A' ' 100' ' ' ALA . 34.6 t0 74.57 83.24 0.11 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.895 0.409 . . . . 0.0 111.957 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.3 -9.44 45.78 Favored Glycine 0 CA--C 1.519 0.294 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.559 HG21 ' O ' ' A' ' 108' ' ' ALA . 2.1 t -116.69 -118.57 0.32 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.33 151.53 4.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.358 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.7 t -112.71 135.36 52.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.099 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -77.62 104.22 8.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.55 0.69 . . . . 0.0 109.553 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 121' ' ' LYS . 13.1 t -100.13 116.99 64.02 Favored Pre-proline 0 C--O 1.204 -1.296 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.637 -179.228 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.494 ' HG2' HG22 ' A' ' 67' ' ' VAL . 38.6 Cg_exo -53.2 -16.06 6.24 Favored 'Trans proline' 0 C--N 1.297 -2.142 0 CA-C-N 121.068 1.417 . . . . 0.0 113.47 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.465 HG11 ' CD2' ' A' ' 85' ' ' HIS . 23.3 t -79.03 -62.11 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.742 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.8 p -99.73 -29.13 12.82 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.463 0.649 . . . . 0.0 109.826 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.429 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.4 OUTLIER 63.94 33.1 12.69 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.22 178.78 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -164.63 138.6 5.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.998 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -145.4 165.57 28.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.993 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.3 m -95.92 -50.99 4.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.357 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -142.45 176.24 9.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.736 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.37 34.48 4.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.428 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.5 ptmt -77.18 -22.53 52.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.21 22.3 14.91 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.448 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 45.5 pt -65.98 -168.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -36.39 115.32 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 O-C-N 124.066 0.854 . . . . 0.0 110.666 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 164.19 -31.76 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 124.914 1.384 . . . . 0.0 109.871 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -86.14 60.19 6.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.934 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -91.31 36.96 0.93 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.712 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.87 -48.4 81.52 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.235 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.0 mmt -84.49 139.32 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.071 0.462 . . . . 0.0 111.029 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -148.35 48.58 1.04 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.508 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.07 159.28 15.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.534 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.3 p -161.56 -39.4 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.821 0.344 . . . . 0.0 110.949 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 80.77 -3.96 72.24 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 86.1 p -107.84 4.33 25.35 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.726 -0.279 . . . . 0.0 110.884 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -64.27 130.34 43.47 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.983 0.421 . . . . 0.0 110.763 -179.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.28 145.19 55.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.394 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -144.21 148.93 35.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.479 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 63.5 p -130.91 160.47 34.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.509 -179.992 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -89.39 37.42 0.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 110.504 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.63 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -63.44 -12.32 30.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.773 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.466 HD23 ' HG3' ' A' ' 63' ' ' GLU . 37.5 mt -49.66 -23.11 1.56 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.125 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -59.46 -44.26 93.03 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.872 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 71.5 mt -104.74 -41.28 5.7 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.621 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.56 -88.04 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.63 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 167.33 -78.92 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.081 0 O-C-N 123.706 0.629 . . . . 0.0 110.92 179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -114.12 167.02 11.04 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.243 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.437 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.5 t -78.24 135.29 37.55 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.49 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.06 -38.71 94.29 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 121.564 -0.35 . . . . 0.0 113.068 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.08 -43.35 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.2 p -107.11 -18.74 13.81 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.865 0.364 . . . . 0.0 111.605 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.47 40.28 8.42 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.294 0.568 . . . . 0.0 110.491 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -130.84 146.77 52.37 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.175 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -52.17 149.23 5.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.601 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.44 HD23 ' HG2' ' A' ' 76' ' ' ARG . 73.6 mt -79.57 105.83 11.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.714 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -85.39 167.25 26.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.94 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.69 -51.57 10.82 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.476 1.451 . . . . 0.0 112.625 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.25 -5.03 33.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.522 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.44 ' HG2' HD23 ' A' ' 72' ' ' LEU . 1.6 tpm_? -66.67 -26.12 66.89 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.838 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 46.71 70.06 2.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 O-C-N 123.584 0.553 . . . . 0.0 109.614 -178.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.423 ' HB3' HD13 ' A' ' 72' ' ' LEU . 36.3 Cg_endo -66.18 145.06 77.47 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.923 2.415 . . . . 0.0 111.697 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -141.93 143.72 33.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.37 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.94 123.51 45.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.839 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.486 HD11 HD22 ' A' ' 92' ' ' LEU . 6.5 mp -83.55 168.19 23.81 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.605 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.471 ' CD ' HD12 ' A' ' 129' ' ' ILE . 11.8 Cg_exo -68.17 -14.57 40.96 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 123.154 2.569 . . . . 0.0 112.28 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.2 p -88.48 -0.77 57.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.237 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 75.52 46.37 0.11 Allowed 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 123.832 0.708 . . . . 0.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -134.12 117.53 16.68 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.881 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.0 m -87.59 141.45 28.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.096 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.7 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -156.88 164.59 37.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.805 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.456 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -62.95 137.22 58.21 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.556 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -56.38 -43.18 79.0 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.042 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.1 92.51 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.471 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.2 m -67.26 -33.56 75.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.29 0.567 . . . . 0.0 110.308 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.7 HD21 ' HB3' ' A' ' 87' ' ' ALA . 90.4 mt -68.81 -28.64 66.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.64 -62.3 6.36 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.562 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.27 -19.35 42.06 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 123.071 2.514 . . . . 0.0 111.758 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.12 -37.63 77.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.577 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.455 -179.94 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.364 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.8 t0 68.68 82.93 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.788 0.328 . . . . 0.0 110.721 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.39 -17.1 37.4 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -116.16 -119.33 0.31 Allowed 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.418 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.4 m -63.17 152.72 7.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.962 0.41 . . . . 0.0 110.096 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.703 ' HB ' HD11 ' A' ' 129' ' ' ILE . 82.8 t -127.98 142.06 44.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.745 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -80.52 125.41 29.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.636 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.7 135.47 19.77 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.331 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.68 -11.14 10.84 Favored 'Trans proline' 0 C--N 1.303 -1.868 0 CA-C-N 120.613 1.255 . . . . 0.0 112.939 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 22.3 t -94.35 -60.86 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.574 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.8 p -98.42 -26.37 14.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.975 0.416 . . . . 0.0 110.543 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mptt 57.64 35.24 25.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.978 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.66 144.81 4.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.918 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.04 153.68 40.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.659 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 92.7 m -95.69 -44.55 7.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.181 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -142.47 160.12 40.9 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.31 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.88 27.02 7.42 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.577 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -61.55 -41.46 97.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.452 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -105.32 16.37 25.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.327 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.703 HD11 ' HB ' ' A' ' 115' ' ' VAL . 0.2 OUTLIER -77.57 -176.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.133 -179.467 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.524 ' CG1' HD13 ' A' ' 92' ' ' LEU . 2.6 m -38.76 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.956 0.785 . . . . 0.0 109.762 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 161.97 -21.31 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.894 1.371 . . . . 0.0 111.244 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -106.89 30.46 6.11 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.978 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -42.43 118.42 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.321 0.581 . . . . 0.0 111.314 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -63.45 -51.92 63.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 171.03 -168.53 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.395 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -115.82 92.46 3.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.878 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.34 -10.01 55.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.007 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.9 p . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 120.782 0.325 . . . . 0.0 110.4 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 120.751 0.31 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -90.23 20.3 4.48 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.403 0.62 . . . . 0.0 111.172 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.635 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.52 -12.2 14.21 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.672 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.444 HD23 ' HG3' ' A' ' 63' ' ' GLU . 47.5 mt -49.61 -23.4 1.67 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.281 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -59.66 -42.28 92.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.014 0.435 . . . . 0.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.96 -40.14 6.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.718 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -85.53 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.635 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 167.1 -80.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 O-C-N 123.98 0.8 . . . . 0.0 110.649 179.087 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -109.24 164.67 12.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.55 0.69 . . . . 0.0 110.714 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.501 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 24.1 t -80.22 136.27 36.43 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.092 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.06 -35.6 89.34 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.399 -0.364 . . . . 0.0 112.727 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.75 -39.35 79.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -177.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.4 p -116.59 -17.43 10.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.487 . . . . 0.0 111.409 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.98 40.23 7.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.586 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.99 147.21 50.49 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.161 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -54.26 149.36 9.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.64 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 78' ' ' PRO . 78.2 mt -79.73 109.46 14.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.92 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -73.51 161.41 79.09 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.451 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -57.79 -40.25 80.52 Favored 'Trans proline' 0 N--CA 1.495 1.571 0 C-N-CA 122.261 1.974 . . . . 0.0 111.742 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -89.68 1.25 56.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.223 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.16 -24.8 65.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.943 0.401 . . . . 0.0 111.681 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 54.3 71.76 1.27 Allowed Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.137 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HB3' HD13 ' A' ' 72' ' ' LEU . 60.0 Cg_endo -72.0 152.26 57.03 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 C-N-CA 122.752 2.302 . . . . 0.0 111.085 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.443 ' HD2' HG12 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -139.75 166.95 23.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.307 -179.559 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 tp -118.43 126.78 52.79 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.44 HD11 HD22 ' A' ' 92' ' ' LEU . 3.8 mp -85.67 168.53 19.35 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -67.08 -15.71 47.31 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 123.332 2.688 . . . . 0.0 112.538 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 11.2 p -93.44 1.12 56.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.4 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.02 51.51 0.11 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.38 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.422 ' CE1' HG11 ' A' ' 119' ' ' VAL . 56.2 m170 -128.07 121.46 29.73 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.51 178.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -87.6 132.37 34.09 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.235 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.695 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -150.22 162.04 41.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.803 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -66.51 136.55 55.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -56.57 -42.06 77.96 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.573 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.96 91.59 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.1 m -68.19 -32.99 73.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.239 0.542 . . . . 0.0 110.009 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.695 HD21 ' HB3' ' A' ' 87' ' ' ALA . 93.7 mt -70.78 -26.67 63.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.849 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.66 -60.0 9.78 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.8 -0.715 . . . . 0.0 111.751 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.31 -16.36 34.15 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.95 2.434 . . . . 0.0 111.993 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.3 -38.47 80.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.679 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.385 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.216 179.929 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.349 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.5 t0 77.38 87.23 0.08 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.018 0.437 . . . . 0.0 111.37 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.36 -18.09 39.24 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.6 t -116.81 -122.84 0.29 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.45 149.38 9.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.113 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.462 ' HB ' HD11 ' A' ' 129' ' ' ILE . 59.4 t -123.49 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.729 -179.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -67.37 92.01 0.28 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.661 0.743 . . . . 0.0 109.688 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 9.1 t -75.33 132.79 75.48 Favored Pre-proline 0 C--O 1.212 -0.89 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.845 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.98 -14.13 35.4 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 120.803 1.322 . . . . 0.0 112.531 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.422 HG11 ' CE1' ' A' ' 85' ' ' HIS . 6.6 t -94.75 -50.37 11.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.296 -0.562 . . . . 0.0 112.414 -178.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.57 -29.27 10.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.377 0.608 . . . . 0.0 110.095 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 57.48 29.51 17.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.828 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -170.31 100.76 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.523 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -100.47 143.48 30.61 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.175 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.43 -54.29 25.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.564 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -145.18 171.69 14.17 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.121 0.486 . . . . 0.0 110.798 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.565 ' O ' HG22 ' A' ' 129' ' ' ILE . 13.7 p -93.57 8.78 39.44 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.552 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.87 -40.95 97.74 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.474 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -101.17 9.86 41.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.627 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.565 HG22 ' O ' ' A' ' 126' ' ' SER . 0.4 OUTLIER -86.15 -172.1 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.655 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.541 ' CG1' HD13 ' A' ' 92' ' ' LEU . 2.6 m -39.32 104.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 O-C-N 123.504 0.503 . . . . 0.0 110.983 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 162.86 -25.02 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 125.022 1.451 . . . . 0.0 110.56 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -104.6 57.55 0.7 Allowed 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.43 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 6.4 p90 -52.38 141.37 19.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.302 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -102.18 -74.97 0.61 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.368 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.1 ttt -151.26 144.43 24.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.726 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -83.92 62.63 7.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.837 0.351 . . . . 0.0 110.182 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -61.5 139.8 58.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.157 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 -179.42 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -89.33 21.34 3.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.253 0.549 . . . . 0.0 110.947 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.622 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.12 -12.23 18.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.674 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.407 HD23 ' HG3' ' A' ' 63' ' ' GLU . 31.5 mt -49.73 -22.31 1.35 Allowed 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.222 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.02 -44.45 91.73 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.822 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 mt -104.81 -41.47 5.63 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.513 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.34 -89.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.622 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.2 mt-10 165.41 -79.99 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.107 0 O-C-N 123.879 0.737 . . . . 0.0 110.799 179.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -106.42 165.74 11.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.181 0.515 . . . . 0.0 110.319 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.441 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 18.9 t -80.02 137.03 36.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.764 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.08 -34.99 82.8 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 121.658 -0.306 . . . . 0.0 112.796 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.99 -42.32 89.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.1 p -111.25 -18.6 12.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.975 0.417 . . . . 0.0 111.234 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 64.17 38.56 8.16 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -128.03 144.32 51.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.207 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 149.37 2.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.395 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.0 mt -78.97 106.9 11.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.641 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.05 157.98 86.28 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.52 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.82 -38.45 95.8 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 121.985 1.79 . . . . 0.0 111.369 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -87.92 -0.59 57.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.308 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.55 -24.67 65.55 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 120.742 0.306 . . . . 0.0 111.703 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 56.56 70.02 1.58 Allowed Pre-proline 0 N--CA 1.442 -0.842 0 CA-C-O 121.405 0.621 . . . . 0.0 109.943 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.91 147.6 74.8 Favored 'Trans proline' 0 C--N 1.301 -1.948 0 C-N-CA 123.052 2.501 . . . . 0.0 111.485 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 mtm-85 -138.02 161.24 37.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.587 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.5 tp -116.97 124.77 50.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.037 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.565 HD11 HD22 ' A' ' 92' ' ' LEU . 5.2 mp -87.99 162.8 39.89 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.414 179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.74 -8.9 24.79 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 123.066 2.511 . . . . 0.0 112.419 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 22.1 p -92.44 2.42 56.68 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.067 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 73.9 41.68 0.4 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.488 0.661 . . . . 0.0 110.989 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -133.32 118.79 18.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.4 m -86.89 139.06 31.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.09 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.704 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -151.66 165.19 35.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.848 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.431 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -70.88 139.35 50.77 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -54.65 -43.41 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.237 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -40.08 92.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.6 m -67.78 -34.73 77.36 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.49 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.704 HD21 ' HB3' ' A' ' 87' ' ' ALA . 82.1 mt -64.93 -31.46 72.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.974 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.7 -63.07 4.4 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.469 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.25 -15.2 46.72 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 122.484 2.122 . . . . 0.0 112.321 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.51 -36.3 75.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.519 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.535 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.323 -179.678 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.242 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 t0 70.87 74.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.848 0.356 . . . . 0.0 110.937 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.17 -17.43 37.61 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -178.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 66.7 p -115.44 -119.31 0.31 Allowed 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.484 0.183 . . . . 0.0 110.513 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.432 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.3 m -59.13 141.97 15.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.214 0.531 . . . . 0.0 110.516 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.9 139.62 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.591 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -84.58 108.18 17.2 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.331 0.586 . . . . 0.0 110.281 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 120' ' ' CYS . 1.6 t -96.61 135.92 22.05 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.414 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -55.16 -18.05 16.78 Favored 'Trans proline' 0 C--N 1.297 -2.144 0 C-N-CA 121.072 1.181 . . . . 0.0 112.86 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.64 -63.09 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.006 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 117' ' ' CYS . 22.4 p -87.62 -28.44 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.86 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 50.53 25.0 1.79 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.851 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -166.53 122.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.845 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -123.91 143.09 50.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.732 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . 0.416 ' HG ' ' HD2' ' A' ' 125' ' ' PHE . 50.8 t -63.47 -51.08 67.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.907 0.384 . . . . 0.0 110.721 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.416 ' HD2' ' HG ' ' A' ' 124' ' ' CYS . 2.5 p90 -146.4 176.02 10.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.341 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.519 ' HA ' HG23 ' A' ' 129' ' ' ILE . 59.5 p -108.04 53.56 0.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.775 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -87.42 -40.39 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.742 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.5 22.82 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 111.581 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.519 HG23 ' HA ' ' A' ' 126' ' ' SER . 1.7 pt -62.87 -171.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.432 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -37.9 109.43 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 O-C-N 123.901 0.751 . . . . 0.0 110.393 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 167.96 -30.78 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 124.793 1.308 . . . . 0.0 111.014 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -84.88 72.65 10.75 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 120.296 -0.561 . . . . 0.0 111.068 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -93.39 26.93 2.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -59.93 -47.78 84.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.942 0.401 . . . . 0.0 110.514 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.4 tpt -73.95 125.96 29.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.812 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -144.62 96.35 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.818 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -124.23 144.44 49.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.605 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 p . . . . . 0 C--N 1.331 -0.207 0 CA-C-O 120.917 0.389 . . . . 0.0 111.007 -179.891 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.912 0.387 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -87.94 22.08 2.48 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.555 0.693 . . . . 0.0 111.051 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.604 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.77 -12.22 16.0 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.777 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.437 HD23 ' HG3' ' A' ' 63' ' ' GLU . 44.2 mt -49.46 -22.97 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.181 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.71 -42.9 94.07 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.535 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.92 -40.29 6.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.639 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.28 -86.6 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.604 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 166.94 -78.38 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 O-C-N 123.906 0.754 . . . . 0.0 110.904 179.426 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -106.71 164.58 11.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.351 0.596 . . . . 0.0 110.438 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.2 t -80.94 137.11 36.12 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.869 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.35 -36.11 88.72 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 121.778 -0.248 . . . . 0.0 112.799 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.697 HG22 ' HG2' ' A' ' 118' ' ' PRO . 61.5 t -59.46 -40.04 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 5.6 p -114.19 -18.3 11.66 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.915 0.388 . . . . 0.0 111.128 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 64.14 38.35 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.347 0.594 . . . . 0.0 110.664 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -127.14 144.4 51.04 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.844 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -51.87 150.87 3.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.715 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.542 HD13 ' HB3' ' A' ' 78' ' ' PRO . 92.3 mt -78.02 105.11 9.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.298 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -79.24 166.89 38.74 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.94 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.31 -47.82 24.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.046 1.831 . . . . 0.0 112.982 -177.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -82.2 2.8 29.98 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.508 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.444 ' HG2' HD23 ' A' ' 72' ' ' LEU . 6.4 tpm_? -63.94 -25.76 68.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.311 -178.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.447 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 79.3 tt0 50.73 65.96 6.08 Favored Pre-proline 0 N--CA 1.446 -0.66 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.581 -178.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.542 ' HB3' HD13 ' A' ' 72' ' ' LEU . 22.6 Cg_exo -62.48 150.19 88.33 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 123.161 2.574 . . . . 0.0 112.279 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mtt85 -149.66 147.24 27.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.155 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.04 114.37 28.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.924 0.392 . . . . 0.0 111.264 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -66.37 165.25 24.58 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 121.066 0.46 . . . . 0.0 110.944 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -63.63 -14.71 44.32 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 C-N-CA 123.091 2.527 . . . . 0.0 112.392 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 18.5 p -90.5 2.87 55.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.352 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 75.41 47.94 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.835 0.71 . . . . 0.0 111.373 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -129.95 121.16 26.03 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.649 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -86.77 133.29 33.67 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.122 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.62 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -154.13 167.15 30.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.646 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -69.11 149.73 48.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.342 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -58.88 -44.43 91.12 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.077 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.45 97.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.881 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.3 m -70.0 -28.05 65.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.658 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.62 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.5 OUTLIER -69.09 -34.31 74.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.375 179.478 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.1 -57.97 10.39 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.97 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.92 -11.87 23.27 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.053 1.836 . . . . 0.0 112.832 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.15 -37.44 80.15 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.014 0.435 . . . . 0.0 110.395 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.392 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.788 -179.683 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.451 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 19.3 t0 73.43 82.38 0.12 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.013 0.435 . . . . 0.0 111.774 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.29 -18.65 35.63 Favored Glycine 0 C--N 1.332 0.332 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.2 t -117.67 -119.99 0.31 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.307 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 123' ' ' GLN . 3.2 m -61.21 155.32 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.941 0.4 . . . . 0.0 110.893 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 73.8 t -119.78 140.1 44.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -84.97 109.3 18.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.811 0.815 . . . . 0.0 111.165 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.1 t -103.5 130.95 22.57 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 114.385 -1.28 . . . . 0.0 109.552 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.697 ' HG2' HG22 ' A' ' 67' ' ' VAL . 36.7 Cg_exo -55.15 -15.4 10.58 Favored 'Trans proline' 0 C--N 1.302 -1.878 0 C-N-CA 121.236 1.291 . . . . 0.0 112.956 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.3 t -92.49 -62.54 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.34 -0.544 . . . . 0.0 112.148 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.6 p -95.49 -26.38 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.565 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 mptt 53.93 24.56 4.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.674 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 tm0? -162.82 128.61 3.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.607 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.411 ' O ' HG12 ' A' ' 114' ' ' VAL . 1.3 mm100 -136.59 139.06 41.86 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . 0.437 ' HG ' ' HD2' ' A' ' 125' ' ' PHE . 53.0 t -61.44 -49.4 76.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 110.295 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.437 ' HD2' ' HG ' ' A' ' 124' ' ' CYS . 5.7 p90 -145.04 177.06 9.04 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.415 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 3.8 p -122.29 48.37 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.278 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -87.15 -22.9 25.04 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.992 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -109.13 18.34 20.67 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.872 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.8 pt -64.06 -169.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.812 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.491 HG13 HD23 ' A' ' 92' ' ' LEU . 2.5 m -39.05 104.32 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.281 0 O-C-N 123.867 0.729 . . . . 0.0 110.237 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 162.91 -13.24 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 124.735 1.272 . . . . 0.0 111.427 -178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -90.85 20.33 4.87 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 119.752 -0.779 . . . . 0.0 111.116 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -42.09 105.77 0.05 Allowed 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.54 0.525 . . . . 0.0 110.952 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -85.05 -74.4 0.4 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 55.0 ttp -152.83 148.61 27.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 78.3 mtm-85 -86.28 65.6 9.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.141 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -55.41 125.27 20.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.783 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 p . . . . . 0 C--N 1.333 -0.132 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.781 -179.541 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.47 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.93 0.395 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.84 20.23 4.94 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.499 0.666 . . . . 0.0 110.651 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.87 -11.68 14.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.819 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.426 HD23 ' HG3' ' A' ' 63' ' ' GLU . 45.8 mt -48.27 -23.51 0.91 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.894 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.53 -44.01 93.29 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.713 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 mt -104.44 -41.83 5.63 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.716 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.81 -89.99 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 165.27 -67.72 0.0 OUTLIER 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.93 0.769 . . . . 0.0 111.455 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -118.11 163.85 16.01 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.271 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 5.3 t -81.51 140.04 34.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.993 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.27 -38.65 93.92 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.334 -0.46 . . . . 0.0 113.283 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -59.96 -44.07 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 26.7 p -106.33 -20.38 13.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.931 0.396 . . . . 0.0 111.582 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 65.04 36.03 7.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.503 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.11 146.5 50.68 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.379 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.0 tpp180 -52.02 148.64 5.86 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.466 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.546 HD13 ' HB3' ' A' ' 78' ' ' PRO . 75.6 mt -73.43 101.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.244 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.446 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 3.7 ptm180 -71.4 166.94 34.3 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.753 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -55.39 -43.1 61.64 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.267 1.978 . . . . 0.0 113.172 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.446 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.7 mt-10 -87.06 2.7 48.84 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.431 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.408 ' HG2' HD23 ' A' ' 72' ' ' LEU . 3.7 tpm_? -64.68 -25.66 68.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.677 0.275 . . . . 0.0 111.333 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 47.8 68.92 3.04 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.809 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.546 ' HB3' HD13 ' A' ' 72' ' ' LEU . 38.9 Cg_endo -66.98 140.77 55.75 Favored 'Trans proline' 0 C--N 1.298 -2.122 0 C-N-CA 122.971 2.447 . . . . 0.0 111.791 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -135.22 145.55 47.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.583 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 tp -100.29 122.18 42.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.417 HD11 HD22 ' A' ' 92' ' ' LEU . 2.2 mp -81.31 166.31 39.15 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.82 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -61.93 -16.68 51.2 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 123.015 2.476 . . . . 0.0 112.139 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.7 p -88.49 -1.22 57.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.403 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.27 45.66 0.19 Allowed 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 123.758 0.661 . . . . 0.0 110.998 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -129.71 122.23 28.5 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.443 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -86.52 138.06 32.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.217 -179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.609 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -153.46 165.64 35.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.731 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -68.73 138.77 55.16 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -56.28 -42.5 77.58 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.025 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.07 92.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 87.1 m -65.81 -36.39 83.36 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.156 0.503 . . . . 0.0 110.349 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.609 HD21 ' HB3' ' A' ' 87' ' ' ALA . 92.0 mt -66.72 -29.66 69.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.173 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.32 -60.67 6.06 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.79 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.57 -16.5 55.02 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.188 1.925 . . . . 0.0 112.452 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.58 -24.59 65.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.655 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.694 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -177.42 58.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.09 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 101.82 -15.96 56.47 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 -179.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 81.3 p -107.07 -121.23 0.24 Allowed 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.289 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 26.5 m -60.5 141.72 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-O 121.137 0.494 . . . . 0.0 109.94 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 50.6 t -107.47 131.12 58.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.581 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 49.4 p-10 -79.29 84.54 5.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.072 0.939 . . . . 0.0 109.901 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.61 137.08 77.37 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.822 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -55.34 -18.69 19.57 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 CA-C-N 120.21 1.111 . . . . 0.0 113.182 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.7 t -95.58 -63.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.479 -0.489 . . . . 0.0 112.202 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 20.7 p -86.6 -28.76 23.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.678 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 49.55 26.14 1.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.975 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -165.31 119.82 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.592 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -123.33 171.19 9.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.621 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 96.1 m -94.78 -51.94 4.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.478 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -145.02 174.98 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.606 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.516 ' HB2' HD13 ' A' ' 129' ' ' ILE . 64.8 p -108.43 50.12 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.054 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.05 -38.75 15.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.567 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.13 19.09 20.88 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.871 0.367 . . . . 0.0 111.774 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.516 HD13 ' HB2' ' A' ' 126' ' ' SER . 8.6 pt -61.41 -170.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.731 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.3 m -38.89 105.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 O-C-N 123.817 0.698 . . . . 0.0 110.547 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 174.91 -34.21 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.583 0 O-C-N 124.286 0.991 . . . . 0.0 110.812 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -84.51 72.53 10.63 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.815 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -68.76 138.14 54.61 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.936 0.398 . . . . 0.0 111.161 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -107.46 -177.09 3.25 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.39 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 98.2 mtp -62.0 149.53 40.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.233 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -79.37 59.3 2.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.201 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -62.05 117.43 5.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.321 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.47 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 85.1 p . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.693 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -89.54 24.89 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.566 0.698 . . . . 0.0 111.064 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.673 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.69 -12.05 14.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.65 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.404 HD23 ' HG3' ' A' ' 63' ' ' GLU . 39.6 mt -48.65 -23.3 0.98 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.171 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.55 -43.08 93.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.01 0.433 . . . . 0.0 110.641 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.8 mt -104.39 -40.61 6.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.647 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.36 -86.71 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.673 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 166.55 -81.02 0.0 OUTLIER 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.79 0.681 . . . . 0.0 110.96 179.088 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.5 p-80 -113.35 163.21 15.14 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.34 0.591 . . . . 0.0 110.416 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 12.8 t -76.11 134.47 39.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.159 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -36.92 92.88 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 116.407 -0.36 . . . . 0.0 112.9 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.5 t -60.04 -42.59 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 22.2 p -110.83 -18.16 13.17 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 63.72 37.84 9.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.391 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -125.31 145.89 49.81 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.773 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -52.67 147.44 8.63 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.26 109.79 8.03 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.874 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -77.71 157.51 79.46 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.112 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.34 -33.76 94.09 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.603 1.535 . . . . 0.0 111.249 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -90.4 -2.08 57.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.375 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -23.91 65.96 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 111.655 -178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.41 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 85.9 tt0 56.12 66.95 3.12 Favored Pre-proline 0 N--CA 1.446 -0.639 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.857 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.41 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.0 Cg_exo -61.99 146.93 96.06 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.995 2.463 . . . . 0.0 111.995 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -140.44 148.15 40.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.417 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 tp -102.69 130.0 49.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.173 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -89.28 166.58 20.89 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 121.081 0.467 . . . . 0.0 111.21 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.43 -20.72 69.59 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 123.268 2.645 . . . . 0.0 112.691 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.6 p -87.42 0.78 55.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.047 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 74.67 47.48 0.12 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.892 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.481 ' CE1' HG11 ' A' ' 119' ' ' VAL . 45.6 m170 -129.6 123.98 32.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.151 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -86.64 131.47 34.14 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.257 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.646 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -144.11 162.52 36.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.485 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.09 149.12 48.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.344 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 t -60.04 -46.52 89.24 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.396 0.617 . . . . 0.0 110.199 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.99 95.58 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.785 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.6 m -70.08 -25.8 63.69 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.959 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.646 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.2 OUTLIER -69.89 -34.36 73.44 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.542 179.623 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -52.99 -58.68 10.94 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.815 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.77 -18.63 21.91 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 123.008 2.472 . . . . 0.0 112.582 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.05 -36.68 75.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.788 0.327 . . . . 0.0 110.344 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.053 179.827 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.293 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.4 t0 74.08 81.37 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.889 0.376 . . . . 0.0 110.572 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.0 -18.13 37.15 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 67.6 p -115.57 -118.85 0.32 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.423 ' O ' HG23 ' A' ' 114' ' ' VAL . 21.3 m -60.68 132.95 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.164 0.507 . . . . 0.0 110.312 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.53 131.27 56.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.066 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -71.14 135.56 47.69 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.591 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.466 ' O ' ' N ' ' A' ' 121' ' ' LYS . 24.3 t -115.75 132.86 22.95 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.814 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -54.33 -17.83 13.04 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 CA-C-N 120.794 1.319 . . . . 0.0 112.493 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.481 HG11 ' CE1' ' A' ' 85' ' ' HIS . 2.7 t -94.38 -50.54 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.48 -31.31 11.35 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.452 0.644 . . . . 0.0 110.265 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.3 mptt 57.65 26.98 13.59 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.831 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -169.64 110.44 0.44 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.779 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -103.25 160.51 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.683 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 74.7 m -93.46 -44.42 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -145.3 167.78 22.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.534 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.564 ' HB2' HD13 ' A' ' 129' ' ' ILE . 51.3 p -105.16 44.45 1.03 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -179.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -88.42 -36.34 16.57 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -108.29 21.25 17.59 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.564 HD13 ' HB2' ' A' ' 126' ' ' SER . 13.3 pt -70.33 -170.02 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.424 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.501 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.7 OUTLIER -38.73 108.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 O-C-N 123.782 0.676 . . . . 0.0 110.39 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.1 -27.33 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 124.613 1.196 . . . . 0.0 110.772 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -84.41 74.46 10.36 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.753 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -85.67 114.02 22.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.031 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -96.79 -179.68 4.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.307 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 17.0 ptm -49.33 159.9 0.28 Allowed 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -98.36 80.24 2.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.446 -179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -80.7 106.61 12.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.553 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.452 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.42 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.506 ' HB3' ' HE ' ' A' ' 71' ' ' ARG . . . . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.83 0.348 . . . . 0.0 110.317 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -92.03 21.87 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.461 0.648 . . . . 0.0 110.847 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.606 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.04 -12.42 11.69 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.815 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.455 HD23 ' HG3' ' A' ' 63' ' ' GLU . 35.5 mt -49.58 -23.64 1.76 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.347 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.39 -43.27 92.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 68.5 mt -104.19 -40.62 6.07 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.936 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.8 -87.87 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.606 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.0 OUTLIER 165.79 -79.28 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 O-C-N 124.06 0.85 . . . . 0.0 110.969 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -108.26 164.43 12.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.166 0.508 . . . . 0.0 110.513 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.518 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 10.6 t -76.17 135.03 39.76 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.931 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.41 -37.8 94.2 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 121.442 -0.409 . . . . 0.0 113.011 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.8 t -62.02 -42.71 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.53 -16.05 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.03 0.443 . . . . 0.0 110.962 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.12 29.22 16.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.415 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -114.89 143.83 44.51 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.496 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.506 ' HE ' ' HB3' ' A' ' 56' ' ' ALA . 33.2 ttt180 -54.4 151.35 7.71 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.769 -178.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.54 104.2 8.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.192 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -77.34 157.22 80.82 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.363 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -56.16 -38.65 94.58 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 C-N-CA 121.787 1.658 . . . . 0.0 111.064 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -86.86 -1.88 58.15 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.898 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -67.86 -24.24 65.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.982 0.42 . . . . 0.0 111.134 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.431 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 78.5 tt0 57.65 65.71 3.3 Favored Pre-proline 0 N--CA 1.445 -0.705 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.296 -178.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.5 Cg_exo -63.05 146.45 94.59 Favored 'Trans proline' 0 C--N 1.301 -1.931 0 C-N-CA 122.367 2.044 . . . . 0.0 111.221 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -140.15 148.79 42.15 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.294 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.6 tp -103.38 127.53 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.142 0.496 . . . . 0.0 111.445 -178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 92' ' ' LEU . 4.4 mp -89.77 164.62 28.2 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.234 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.41 -6.73 19.8 Favored 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 123.037 2.491 . . . . 0.0 112.532 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 20.0 p -94.11 -0.87 55.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.404 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 77.46 41.52 0.14 Allowed 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 123.926 0.766 . . . . 0.0 110.969 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.479 ' NE2' HG11 ' A' ' 119' ' ' VAL . 33.4 m170 -134.58 119.2 18.11 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.679 178.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.5 m -87.02 140.26 29.74 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.712 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -152.41 164.1 38.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.578 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -65.34 137.59 57.62 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -56.32 -43.43 78.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.516 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.74 91.12 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 84.2 m -67.48 -33.55 75.34 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.53 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.712 HD21 ' HB3' ' A' ' 87' ' ' ALA . 74.7 mt -65.53 -37.33 86.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.04 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -47.57 -63.71 3.28 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.78 -27.03 69.47 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.882 2.388 . . . . 0.0 111.787 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.02 -39.67 86.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.559 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.531 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.054 179.447 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.9 t0 70.23 76.2 0.2 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.924 0.392 . . . . 0.0 110.972 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.64 -13.16 46.77 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.4 p -115.99 -120.64 0.3 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.549 -0.325 . . . . 0.0 110.451 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.0 m -64.24 151.66 9.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.058 0.456 . . . . 0.0 110.673 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.89 133.89 65.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.819 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.23 113.71 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.151 0.501 . . . . 0.0 110.025 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.96 138.31 19.77 Favored Pre-proline 0 C--O 1.213 -0.828 0 CA-C-N 115.228 -0.897 . . . . 0.0 108.832 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.66 -15.41 48.58 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 121.165 1.243 . . . . 0.0 112.58 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.479 HG11 ' NE2' ' A' ' 85' ' ' HIS . 52.1 t -94.46 -61.99 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.576 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -90.45 -24.85 20.6 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.433 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.7 mptt 49.75 24.25 1.2 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.839 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.13 116.37 0.84 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -118.38 156.97 28.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.615 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 6.4 t -83.46 -49.95 8.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.15 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -141.19 176.8 8.55 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.489 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.03 50.79 1.11 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.56 0.695 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -85.03 -26.84 26.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.462 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -113.62 23.72 12.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 111.43 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 15.3 pt -60.16 -172.34 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.784 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.406 HG12 ' CD1' ' A' ' 92' ' ' LEU . 2.5 m -41.24 104.58 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 O-C-N 123.758 0.662 . . . . 0.0 110.698 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.38 -33.52 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.405 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -82.96 68.57 9.5 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.573 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -95.67 32.73 1.77 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -61.71 -39.04 90.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.55 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.7 mmt -95.14 127.61 41.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.104 0.478 . . . . 0.0 110.9 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -136.51 45.4 2.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.754 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -62.8 145.2 55.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.636 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.558 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.456 -0.125 0 CA-C-O 120.813 0.339 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -89.27 12.39 16.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -58.97 -11.29 3.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.11 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.478 HD23 ' HG3' ' A' ' 63' ' ' GLU . 55.1 mt -47.39 -28.15 1.96 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.515 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -49.26 -45.98 45.61 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.67 -40.84 5.86 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.599 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.1 -83.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 123.432 0.457 . . . . 0.0 109.777 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.617 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.9 OUTLIER 164.65 -76.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.091 0.869 . . . . 0.0 111.303 179.383 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 -103.06 165.2 11.16 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.386 0.612 . . . . 0.0 110.41 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 20.2 t -81.35 135.94 35.71 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.205 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.09 92.67 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 116.521 -0.308 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.37 -41.16 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 4.4 p -113.56 -16.16 12.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.923 0.392 . . . . 0.0 111.16 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 62.99 38.83 10.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.319 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -128.1 145.28 51.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.098 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -51.69 153.78 2.25 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.336 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 78' ' ' PRO . 85.5 mt -82.56 102.42 11.39 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.863 -178.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -66.56 162.17 52.73 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.151 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.31 -39.24 86.06 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 121.924 1.75 . . . . 0.0 111.05 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -90.17 0.81 56.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.512 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -66.88 -23.74 66.04 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.126 0.489 . . . . 0.0 110.784 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 50.61 74.51 0.79 Allowed Pre-proline 0 N--CA 1.45 -0.429 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.583 ' HB3' HD13 ' A' ' 72' ' ' LEU . 65.7 Cg_endo -70.71 152.81 64.67 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 123.03 2.487 . . . . 0.0 112.283 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -147.14 152.43 38.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.656 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 tp -108.92 128.41 54.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.313 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -83.84 165.58 38.66 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.295 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -62.4 -16.7 53.37 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 123.126 2.551 . . . . 0.0 112.251 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.5 p -88.42 -0.9 57.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.4 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.34 49.17 0.07 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.432 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -133.99 124.02 25.59 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.605 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.4 m -86.52 140.28 30.06 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.307 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.584 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -156.08 163.83 39.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.916 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.3 m -65.14 149.87 49.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.211 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.3 t -59.99 -46.35 89.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.645 0.736 . . . . 0.0 109.796 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.23 96.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.271 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 99.4 m -69.88 -26.79 64.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 109.729 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.584 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -66.9 -38.25 85.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.696 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.9 -60.17 7.31 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.81 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.21 -29.29 37.15 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 123.283 2.655 . . . . 0.0 112.372 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.84 -38.4 81.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.186 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.04 179.628 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.348 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t0 71.95 79.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.892 0.377 . . . . 0.0 111.006 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.58 -16.43 40.77 Favored Glycine 0 N--CA 1.453 -0.213 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.5 p -114.91 -120.55 0.3 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.647 -0.276 . . . . 0.0 110.356 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.413 ' H ' HG13 ' A' ' 114' ' ' VAL . 2.7 m -66.96 138.33 23.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.415 -179.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.1 t -110.47 132.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.8 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 122.52 25.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.731 0.777 . . . . 0.0 109.944 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 49.7 t -108.94 135.52 20.13 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.655 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.41 -11.19 15.64 Favored 'Trans proline' 0 C--N 1.302 -1.897 0 C-N-CA 121.084 1.19 . . . . 0.0 112.679 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -93.97 -62.41 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.648 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 10.2 p -96.8 -24.73 15.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.936 0.398 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 54.73 29.54 11.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.808 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -156.48 139.03 14.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.118 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -141.64 158.42 43.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.714 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 34.6 t -94.66 -55.04 3.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.169 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -144.0 175.18 10.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.564 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.531 ' HA ' HG23 ' A' ' 129' ' ' ILE . 78.9 p -104.46 54.24 0.73 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.674 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -87.62 -43.03 12.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.528 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -107.8 19.23 20.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.667 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.531 HG23 ' HA ' ' A' ' 126' ' ' SER . 3.7 pt -59.02 -172.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.624 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.477 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -39.33 112.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 O-C-N 123.827 0.704 . . . . 0.0 110.608 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 165.74 -29.62 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 124.621 1.201 . . . . 0.0 110.713 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -87.64 101.14 13.36 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.742 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 48.2 p90 -108.37 143.63 37.02 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.608 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -108.66 -81.01 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 16.8 tpt -145.09 141.24 28.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -89.27 44.55 1.22 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.742 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -81.82 146.41 29.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.686 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 52.7 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 71' ' ' ARG . . . . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.12 0.486 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -88.93 30.72 0.91 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.442 0.639 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.634 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.92 -12.5 18.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.529 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.438 HD23 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mt -49.23 -23.63 1.43 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.242 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -59.24 -43.21 92.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.989 0.423 . . . . 0.0 110.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.0 mt -104.3 -40.64 6.04 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.94 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.27 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.634 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.9 OUTLIER 165.12 -79.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 O-C-N 123.987 0.804 . . . . 0.0 110.978 178.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -106.2 166.4 10.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.239 0.542 . . . . 0.0 110.688 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.6 t -79.2 135.34 36.77 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.259 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.28 -37.91 93.28 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.615 -0.326 . . . . 0.0 112.851 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.32 -41.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.0 p -110.04 -18.07 13.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.95 0.405 . . . . 0.0 111.204 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.34 39.67 9.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.53 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -128.76 144.1 51.08 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.123 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.562 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 7.8 ttm180 -50.7 152.6 1.97 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.366 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -81.14 112.47 18.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.977 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -82.78 158.38 65.35 Favored Pre-proline 0 N--CA 1.462 0.162 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.394 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.12 -40.24 86.15 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.063 1.842 . . . . 0.0 111.831 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -85.97 -0.32 55.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.43 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -67.51 -24.99 65.63 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 111.482 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.435 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 81.9 tt0 56.27 65.72 3.97 Favored Pre-proline 0 N--CA 1.444 -0.766 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.841 -177.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.435 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.4 Cg_exo -63.08 147.34 94.43 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.736 2.291 . . . . 0.0 111.545 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.432 ' HD3' HG23 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -143.69 149.54 37.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.241 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.99 123.56 48.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.119 0.485 . . . . 0.0 112.154 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.586 HD11 HD22 ' A' ' 92' ' ' LEU . 2.7 mp -77.37 165.73 49.52 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.626 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -64.84 -16.17 54.03 Favored 'Trans proline' 0 C--N 1.307 -1.61 0 C-N-CA 123.245 2.63 . . . . 0.0 112.16 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 9.9 p -91.12 1.4 57.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.101 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 75.76 49.81 0.07 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.566 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.44 ' CD2' HG11 ' A' ' 119' ' ' VAL . 32.7 m170 -134.14 125.43 27.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.752 178.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.8 m -85.58 142.46 29.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.084 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.691 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -156.52 163.06 39.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.673 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.6 m -69.61 135.36 49.87 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.433 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.2 t -56.23 -39.8 73.09 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.634 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.97 88.38 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.7 m -67.24 -36.84 82.49 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.624 0.725 . . . . 0.0 110.215 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.691 HD21 ' HB3' ' A' ' 87' ' ' ALA . 73.3 mt -64.29 -35.96 82.54 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.776 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.47 -62.92 4.06 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.726 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.97 -21.4 27.89 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.512 2.142 . . . . 0.0 112.03 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.443 ' O ' HG13 ' A' ' 115' ' ' VAL . . . -68.57 75.96 0.28 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.475 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.95 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.9 t0 63.45 70.19 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.945 0.402 . . . . 0.0 110.8 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.03 -8.51 38.89 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.6 p -116.16 -120.09 0.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.405 ' H ' HG13 ' A' ' 114' ' ' VAL . 2.4 m -62.72 145.11 13.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.074 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 95' ' ' ALA . 90.6 t -112.09 133.29 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.21 0.528 . . . . 0.0 111.63 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -74.22 106.42 5.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.829 0.824 . . . . 0.0 110.057 179.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 121' ' ' LYS . 7.6 t -104.05 126.99 30.21 Favored Pre-proline 0 C--O 1.202 -1.406 0 CA-C-N 114.756 -1.111 . . . . 0.0 108.63 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.32 -9.08 22.54 Favored 'Trans proline' 0 C--N 1.296 -2.226 0 CA-C-N 121.188 1.46 . . . . 0.0 113.171 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.44 HG11 ' CD2' ' A' ' 85' ' ' HIS . 40.5 t -85.82 -54.88 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.147 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.4 p -105.49 -27.79 11.2 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.118 0.485 . . . . 0.0 110.482 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 0.3 OUTLIER 62.05 35.9 15.7 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.209 178.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -166.74 141.84 4.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -150.22 158.75 44.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.638 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 79.2 m -96.04 -47.38 6.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.438 . . . . 0.0 110.089 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -142.61 176.45 9.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.355 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.55 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.6 OUTLIER -120.87 46.74 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.374 179.601 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.23 -30.45 19.69 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.349 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -106.19 16.74 24.5 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.55 HD13 ' HB2' ' A' ' 126' ' ' SER . 44.5 pt -70.95 -169.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.99 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.432 HG23 ' HD3' ' A' ' 79' ' ' ARG . 0.2 OUTLIER -41.67 109.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 O-C-N 123.727 0.642 . . . . 0.0 110.075 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 163.92 -34.25 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 124.827 1.33 . . . . 0.0 111.072 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -59.59 -42.23 92.08 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 75.9 t80 37.9 73.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.965 0.79 . . . . 0.0 111.193 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.76 -50.3 74.36 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.99 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.3 ttt 178.03 -165.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.385 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.7 mtm180 -116.6 92.81 3.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.807 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.93 -36.62 79.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.922 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 121.001 0.429 . . . . 0.0 110.449 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -86.74 26.59 1.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.49 0.662 . . . . 0.0 110.709 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.15 -12.1 11.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.584 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.438 HD23 ' HG3' ' A' ' 63' ' ' GLU . 46.3 mt -47.48 -23.8 0.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.989 179.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -59.66 -43.09 94.07 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.643 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.0 mt -103.96 -40.95 6.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.366 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.46 -88.28 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.683 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.4 mt-10 164.6 -81.17 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.85 0.718 . . . . 0.0 110.891 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -102.22 168.91 9.05 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.095 0.474 . . . . 0.0 110.134 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.423 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 12.4 t -84.34 138.43 32.89 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.032 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.28 -36.41 89.55 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.584 -0.341 . . . . 0.0 113.075 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.7 t -59.61 -43.16 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.7 p -109.0 -20.53 13.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.968 0.414 . . . . 0.0 111.305 -178.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 65.62 34.26 7.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.421 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -126.42 145.69 50.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.119 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 9.6 ttm-85 -49.71 149.75 2.37 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.531 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.18 115.58 14.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.772 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -80.75 162.08 61.53 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.507 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.27 -38.08 46.41 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 121.791 1.66 . . . . 0.0 111.585 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.65 0.61 57.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.821 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -24.28 66.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.91 0.386 . . . . 0.0 111.522 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 55.92 69.0 2.04 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-O 121.289 0.566 . . . . 0.0 110.206 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.54 151.68 70.36 Favored 'Trans proline' 0 C--N 1.299 -2.027 0 C-N-CA 123.442 2.762 . . . . 0.0 111.963 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -144.87 167.01 23.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.821 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.38 126.26 51.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.569 HD11 HD22 ' A' ' 92' ' ' LEU . 3.9 mp -86.63 164.68 36.39 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.278 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.46 -6.0 18.06 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.926 2.417 . . . . 0.0 112.063 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -94.33 2.34 55.83 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.333 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 76.42 39.15 0.27 Allowed 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.513 0.673 . . . . 0.0 111.222 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.494 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.1 m170 -134.5 120.29 19.52 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.944 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.9 m -86.56 142.83 28.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.779 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -154.13 167.41 29.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.882 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.437 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -71.32 136.13 47.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.6 t -53.04 -42.96 66.25 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.92 91.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.2 m -68.44 -33.58 74.45 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.659 0.742 . . . . 0.0 110.495 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.779 HD21 ' HB3' ' A' ' 87' ' ' ALA . 70.4 mt -63.97 -36.37 83.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.162 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.77 -65.27 2.94 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.97 -29.73 74.8 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.016 2.477 . . . . 0.0 111.551 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.69 -38.17 77.67 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.463 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.459 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.461 179.656 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.54 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.7 t0 67.89 83.84 0.16 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 110.924 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.42 -18.26 35.81 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.7 p -115.22 -120.71 0.3 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.656 -0.272 . . . . 0.0 110.318 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.431 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.0 m -63.17 142.94 16.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.936 0.398 . . . . 0.0 110.203 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 96.7 t -113.48 139.95 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.253 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.4 116.17 21.75 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.395 0.617 . . . . 0.0 109.894 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 48.9 t -106.04 133.99 19.96 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.196 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.73 -11.35 11.54 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.272 1.315 . . . . 0.0 113.302 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.494 HG11 ' NE2' ' A' ' 85' ' ' HIS . 15.0 t -94.59 -62.14 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.475 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.7 p -97.14 -26.55 14.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.017 0.436 . . . . 0.0 110.568 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.6 mptt 56.25 27.51 11.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.707 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -160.37 136.24 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.947 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -141.6 161.81 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.67 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . 0.564 ' HG ' ' HD1' ' A' ' 125' ' ' PHE . 11.7 p -95.28 -43.81 7.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.363 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.564 ' HD1' ' HG ' ' A' ' 124' ' ' CYS . 50.8 m-85 -143.26 177.08 8.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.896 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.445 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.2 OUTLIER -119.99 53.53 1.07 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 111.58 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -88.65 -30.34 19.25 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.699 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -112.62 23.06 13.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.615 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.445 HD13 ' HB2' ' A' ' 126' ' ' SER . 18.0 pt -70.15 -172.95 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 120.882 0.372 . . . . 0.0 111.35 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -45.25 106.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.574 179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 163.87 -40.1 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 124.973 1.421 . . . . 0.0 111.106 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -89.99 72.88 7.41 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.691 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 p90 -68.14 143.56 55.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.108 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -78.38 0.57 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.395 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.0 mmm -129.42 147.11 51.21 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.616 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.6 mtm-85 -110.31 42.17 1.61 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.454 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -73.15 153.14 40.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.641 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.611 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 79.2 p . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.878 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.884 0.373 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -86.38 42.54 1.0 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.653 0.739 . . . . 0.0 110.73 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.715 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.85 -13.3 23.09 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.999 -1.0 . . . . 0.0 111.366 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.441 HD23 ' HG3' ' A' ' 63' ' ' GLU . 32.3 mt -47.31 -24.58 0.79 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.411 0.444 . . . . 0.0 110.969 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -60.28 -44.35 95.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.989 0.423 . . . . 0.0 110.806 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 80' ' ' LEU . 83.1 mt -103.58 -42.63 5.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.658 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.07 -90.63 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.715 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.4 OUTLIER 166.22 -80.13 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.703 0.801 . . . . 0.0 111.298 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -107.59 165.42 11.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.359 0.6 . . . . 0.0 110.346 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.426 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 40.9 t -79.62 147.76 31.93 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.606 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -35.98 40.35 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.187 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 68.1 t -62.57 -37.6 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.932 0.396 . . . . 0.0 111.498 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 -26.19 10.76 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.383 -178.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 66.51 24.66 10.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.791 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -122.26 150.3 42.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.236 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -50.91 150.17 3.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.28 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.8 mt -80.59 118.41 22.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.347 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.28 165.72 16.25 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.022 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -52.56 -51.19 11.69 Favored 'Trans proline' 0 C--N 1.303 -1.862 0 C-N-CA 122.164 1.909 . . . . 0.0 112.96 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -72.14 -7.42 49.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.079 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.28 -24.34 64.86 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 121.106 -0.238 . . . . 0.0 110.919 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 49.03 71.64 1.53 Allowed Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 121.075 0.465 . . . . 0.0 110.086 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.58 148.13 82.96 Favored 'Trans proline' 0 C--N 1.295 -2.244 0 C-N-CA 122.819 2.346 . . . . 0.0 112.15 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.39 144.77 32.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.925 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 61' ' ' LEU . 0.6 OUTLIER -100.46 126.09 46.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.094 0.473 . . . . 0.0 111.104 -179.705 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 92' ' ' LEU . 4.6 mp -87.95 164.15 34.96 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.988 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -70.59 -6.77 19.78 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 C-N-CA 122.784 2.323 . . . . 0.0 112.025 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.8 p -94.56 2.52 55.66 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.509 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 74.45 41.59 0.35 Allowed 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.96 0.787 . . . . 0.0 111.074 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.432 ' NE2' HG11 ' A' ' 119' ' ' VAL . 33.6 m170 -134.62 118.15 16.89 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.031 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.46 135.55 33.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.242 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.701 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -149.89 167.46 26.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.512 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.3 m -71.6 135.49 46.99 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.955 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.4 t -51.63 -44.08 62.82 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.491 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.06 92.78 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.589 -0.445 . . . . 0.0 109.946 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 89.6 m -68.29 -33.53 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.698 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.701 HD21 ' HB3' ' A' ' 87' ' ' ALA . 88.7 mt -65.14 -35.43 81.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.486 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -44.29 -64.98 1.82 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.12 -20.74 71.85 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.633 2.222 . . . . 0.0 112.137 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.99 -38.29 85.49 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.032 0.444 . . . . 0.0 109.899 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.631 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.368 -179.916 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.354 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.6 t0 64.5 77.23 0.32 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.737 0.303 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.55 -15.9 45.15 Favored Glycine 0 N--CA 1.452 -0.281 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 -179.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 80.9 p -115.58 -121.14 0.3 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.666 -0.267 . . . . 0.0 110.998 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.403 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.1 m -61.8 143.67 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 120.871 0.367 . . . . 0.0 110.052 -179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 69.5 t -110.99 137.32 43.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.479 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.72 113.44 19.7 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.608 0.718 . . . . 0.0 111.035 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 121' ' ' LYS . 42.7 t -104.11 133.78 20.05 Favored Pre-proline 0 C--N 1.312 -1.042 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.464 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.29 -10.45 8.51 Favored 'Trans proline' 0 C--N 1.301 -1.961 0 C-N-CA 121.682 1.588 . . . . 0.0 113.433 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 85' ' ' HIS . 38.9 t -94.81 -61.82 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.939 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 13.0 p -98.12 -29.5 13.2 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 110.95 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.0 mptt 58.01 28.99 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -161.42 137.29 7.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.717 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -143.85 154.38 43.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.732 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 5.6 t -83.76 -50.05 8.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -139.25 176.98 8.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.869 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.99 45.23 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.735 0.778 . . . . 0.0 111.599 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -86.53 -19.58 29.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.414 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.59 22.63 13.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.999 0.428 . . . . 0.0 110.908 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 25.2 pt -63.71 -170.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.5 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -40.69 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 O-C-N 123.895 0.747 . . . . 0.0 110.66 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 175.38 -31.74 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 124.186 0.929 . . . . 0.0 110.79 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -84.96 71.05 10.97 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.126 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -92.66 31.14 1.4 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.938 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.38 -37.26 80.19 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.425 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 36.5 tpp -82.55 109.33 16.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.799 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.1 mtm180 -152.78 82.97 1.22 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.802 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -119.97 11.39 11.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.019 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 C--N 1.326 -0.415 0 CA-C-O 120.739 0.304 . . . . 0.0 110.241 -179.584 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 121.105 0.478 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -88.22 30.66 0.85 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.432 0.634 . . . . 0.0 110.669 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.633 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.12 -12.47 12.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.51 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.43 HD23 ' HG3' ' A' ' 63' ' ' GLU . 39.5 mt -48.5 -23.76 1.08 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.334 179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.05 -42.65 90.77 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.475 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.9 mt -104.17 -39.98 6.32 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.785 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.2 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.633 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.6 OUTLIER 164.94 -79.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 O-C-N 124.114 0.884 . . . . 0.0 111.045 178.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -108.03 166.92 10.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.263 0.554 . . . . 0.0 110.468 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.426 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 10.0 t -77.37 135.66 38.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.309 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.26 -38.22 94.87 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.492 -0.385 . . . . 0.0 112.779 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.432 HG22 ' HG3' ' A' ' 118' ' ' PRO . 72.4 t -61.41 -42.54 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.14 -16.33 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 111.074 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.28 28.8 15.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.548 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -115.6 145.28 42.83 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.915 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -52.71 149.24 6.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.447 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.71 103.19 5.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.812 -178.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -71.38 157.72 89.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.385 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -37.14 95.65 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 121.616 1.544 . . . . 0.0 110.785 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.18 0.7 55.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.209 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -67.33 -24.76 65.77 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 111.332 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.439 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 87.6 tt0 53.72 66.28 4.67 Favored Pre-proline 0 N--CA 1.438 -1.042 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.418 -177.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.9 Cg_exo -62.0 146.2 96.38 Favored 'Trans proline' 0 C--N 1.302 -1.887 0 C-N-CA 122.458 2.105 . . . . 0.0 111.906 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.436 ' CB ' HD22 ' A' ' 92' ' ' LEU . 95.9 mtt180 -138.82 142.67 38.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.541 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.6 tp -99.82 126.55 45.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.307 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.522 HD23 ' OE1' ' A' ' 123' ' ' GLN . 1.9 mp -83.45 165.59 39.46 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.884 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -64.74 -14.42 44.7 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 123.205 2.604 . . . . 0.0 112.502 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -92.15 1.04 57.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.15 46.72 0.09 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.04 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -131.11 119.32 21.77 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.487 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -87.1 132.53 33.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.995 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.616 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -147.25 162.37 39.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.4 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.7 m -59.52 147.56 36.41 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.27 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -60.42 -44.28 95.91 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.344 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.47 -40.63 97.28 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.901 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.9 m -67.64 -34.12 76.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.064 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.616 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -63.86 -36.99 85.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.155 -179.129 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.61 -59.99 7.34 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.327 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -64.0 -16.42 54.8 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.43 2.087 . . . . 0.0 112.139 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.34 -37.58 81.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.008 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.625 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.606 179.664 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.172 -1.171 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.5 t0 75.47 81.34 0.1 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.051 0.453 . . . . 0.0 111.459 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.75 -17.34 45.97 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.26 -123.18 0.29 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.1 m -62.05 148.08 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-O 121.416 0.627 . . . . 0.0 110.715 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 88.3 t -107.57 141.52 22.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.205 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.34 135.08 34.04 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.971 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 42.0 t -122.82 134.25 24.92 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.369 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.432 ' HG3' HG22 ' A' ' 67' ' ' VAL . 34.5 Cg_endo -64.91 -9.16 20.26 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 CA-C-N 120.431 1.19 . . . . 0.0 112.556 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 17.3 t -93.26 -61.27 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.326 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 29.1 p -99.51 -22.28 15.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.4 mptt 55.07 29.25 12.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.157 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -162.03 129.92 4.05 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.988 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.522 ' OE1' HD23 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -122.72 130.59 53.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.895 179.49 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 93.4 m -61.69 -47.7 84.1 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.772 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -145.2 176.8 9.26 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.465 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.423 ' HA ' HG23 ' A' ' 129' ' ' ILE . 0.1 OUTLIER -109.3 32.18 5.17 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.017 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -86.2 -31.17 21.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.628 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -103.86 22.49 14.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.884 0.373 . . . . 0.0 111.668 -179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.423 HG23 ' HA ' ' A' ' 126' ' ' SER . 41.3 pt -68.19 -169.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.775 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.424 HG13 HD23 ' A' ' 92' ' ' LEU . 2.2 m -36.49 104.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 O-C-N 124.045 0.84 . . . . 0.0 110.828 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 170.79 -32.75 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 124.027 0.829 . . . . 0.0 110.362 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -83.45 64.36 7.81 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.795 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -97.81 29.25 3.47 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.414 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.4 -48.01 83.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.628 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.7 tpt -77.31 119.83 21.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.23 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.8 mtm180 -123.8 35.82 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.035 0.445 . . . . 0.0 110.806 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.47 141.89 58.18 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.757 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.132 179.937 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.435 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 121.093 0.473 . . . . 0.0 110.387 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 49.7 mp0 -84.0 32.42 0.48 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.475 0.655 . . . . 0.0 110.823 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.664 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.87 -11.65 13.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.405 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.404 HD23 ' HG3' ' A' ' 63' ' ' GLU . 55.5 mt -48.36 -22.36 0.68 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.612 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -58.44 -42.37 87.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.068 0.461 . . . . 0.0 110.206 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.5 mt -104.31 -39.59 6.42 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.72 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.26 -84.1 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.664 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.1 mt-10 166.52 -80.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.978 0.799 . . . . 0.0 110.966 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.99 170.14 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.104 0.478 . . . . 0.0 110.157 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.461 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 23.8 t -87.59 141.87 28.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.335 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.29 -39.21 92.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.653 -0.308 . . . . 0.0 112.38 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 74.9 t -61.52 -37.91 78.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -24.67 10.89 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.177 0.513 . . . . 0.0 111.116 -178.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 65.43 33.0 9.17 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.836 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -128.81 149.08 50.89 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.78 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -52.6 147.94 7.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.904 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.456 HD13 ' HB3' ' A' ' 78' ' ' PRO . 73.6 mt -72.78 116.51 13.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.001 -178.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.95 161.8 72.32 Favored Pre-proline 0 N--CA 1.463 0.224 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.305 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.67 -40.26 74.95 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.083 1.856 . . . . 0.0 111.641 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -90.03 1.92 55.78 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.296 179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.29 -24.83 66.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.669 -178.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 52.48 70.56 1.82 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-O 121.351 0.596 . . . . 0.0 109.899 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.456 ' HB3' HD13 ' A' ' 72' ' ' LEU . 57.4 Cg_endo -70.11 153.57 67.18 Favored 'Trans proline' 0 C--N 1.294 -2.32 0 C-N-CA 122.843 2.362 . . . . 0.0 111.412 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.412 ' HD2' HG12 ' A' ' 130' ' ' VAL . 0.0 OUTLIER -148.6 174.62 11.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.506 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -126.06 141.07 52.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.986 0.422 . . . . 0.0 111.33 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.534 ' CD1' HD22 ' A' ' 92' ' ' LEU . 2.2 mp -101.17 165.6 13.88 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-O 121.136 0.493 . . . . 0.0 110.897 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.51 -16.45 54.69 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.318 2.679 . . . . 0.0 112.155 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 26.7 p -86.31 -6.09 59.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.317 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 78.14 48.01 0.05 OUTLIER 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.923 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -129.98 121.74 27.13 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.295 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.4 m -87.06 138.64 31.32 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.998 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.695 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -157.92 166.69 31.98 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.127 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.468 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.7 m -68.83 139.68 55.22 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 t -56.75 -42.84 80.02 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.298 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.38 -40.41 94.22 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 97.8 m -71.01 -22.14 62.2 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.235 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.695 HD21 ' HB3' ' A' ' 87' ' ' ALA . 84.3 mt -81.17 -20.72 40.63 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.525 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -59.84 -53.42 46.07 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 120.556 -0.831 . . . . 0.0 111.571 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.24 -19.31 33.85 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.641 2.227 . . . . 0.0 111.779 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.99 -38.19 78.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.447 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.992 -179.947 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.9 t0 69.22 76.75 0.23 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.08 -17.68 37.54 Favored Glycine 0 N--CA 1.452 -0.236 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 82.2 p -115.11 -120.92 0.3 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.568 -0.316 . . . . 0.0 110.17 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.29 142.83 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 121.017 0.437 . . . . 0.0 110.311 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.3 t -107.17 129.84 60.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.717 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -74.29 123.76 25.17 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.964 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 121' ' ' LYS . 23.4 t -106.76 129.65 24.09 Favored Pre-proline 0 C--O 1.199 -1.57 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.874 -179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -61.36 -10.22 15.28 Favored 'Trans proline' 0 C--N 1.295 -2.273 0 CA-C-N 121.715 1.648 . . . . 0.0 113.34 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.7 t -85.81 -43.73 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.394 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -120.21 -30.07 4.71 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.503 0.668 . . . . 0.0 110.307 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.9 OUTLIER 65.14 35.16 8.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.146 178.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -164.3 123.12 1.87 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.32 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.13 159.64 23.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.344 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.2 m -87.59 -55.85 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.58 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -143.52 176.82 8.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 16.0 p -101.82 27.2 6.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.022 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -88.52 -28.83 20.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.382 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -112.72 22.68 14.27 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.654 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.1 pt -86.04 -169.95 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.966 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.412 HG12 ' HD2' ' A' ' 79' ' ' ARG . 2.2 m -43.27 106.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 O-C-N 123.721 0.638 . . . . 0.0 110.248 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.64 -22.41 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 124.408 1.067 . . . . 0.0 110.864 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -97.56 22.62 8.69 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.983 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -41.2 139.29 1.0 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.416 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -161.52 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.088 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.08 144.02 50.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.947 0.403 . . . . 0.0 110.059 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -82.66 68.45 9.13 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.458 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.58 134.27 54.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.922 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 12.6 p . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.624 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.636 ' HB3' ' HE ' ' A' ' 71' ' ' ARG . . . . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -95.26 20.5 9.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.397 0.618 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.0 -12.32 18.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.63 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.416 HD23 ' HG3' ' A' ' 63' ' ' GLU . 36.6 mt -49.01 -23.67 1.24 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.165 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -59.68 -43.5 93.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.691 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 80' ' ' LEU . 57.5 mt -104.47 -41.56 5.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.599 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.74 -89.93 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.631 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 165.24 -79.03 0.0 OUTLIER 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.5 0.72 . . . . 0.0 110.836 179.569 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -99.87 167.22 10.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.117 0.484 . . . . 0.0 110.116 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 27.2 t -82.05 136.72 35.19 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.516 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -71.46 -30.07 67.26 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.72 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.1 t -61.53 -39.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.23 -17.39 11.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 0.0 111.22 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.75 38.43 9.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.791 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -129.3 144.9 51.4 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.043 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.636 ' HE ' ' HB3' ' A' ' 56' ' ' ALA . 42.4 ttt180 -50.71 148.89 3.64 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.426 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.4 HD13 ' HB3' ' A' ' 78' ' ' PRO . 80.0 mt -75.47 120.24 20.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.466 -178.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -82.76 163.03 53.4 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.204 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.08 -34.09 47.93 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 121.908 1.738 . . . . 0.0 111.579 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -92.68 -2.03 56.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.389 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -66.89 -23.88 66.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.233 0.54 . . . . 0.0 111.514 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 54.72 70.34 1.7 Allowed Pre-proline 0 N--CA 1.446 -0.636 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.877 -178.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.4 ' HB3' HD13 ' A' ' 72' ' ' LEU . 40.3 Cg_endo -67.49 149.26 80.04 Favored 'Trans proline' 0 C--N 1.3 -1.986 0 C-N-CA 123.148 2.565 . . . . 0.0 111.913 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -141.7 162.29 35.85 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.131 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 61' ' ' LEU . 57.6 tp -115.44 127.69 55.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.903 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.75 164.55 36.62 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.842 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 -6.42 19.04 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.92 2.413 . . . . 0.0 112.334 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.6 p -95.38 3.95 53.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 75.22 41.21 0.3 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.521 0.677 . . . . 0.0 111.346 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.495 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.3 m170 -134.55 119.75 18.82 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.732 178.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.9 m -86.64 139.63 30.61 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.911 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.648 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -149.95 166.86 28.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 -179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -68.2 151.84 46.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.697 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.4 t -60.35 -47.15 87.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.337 0.589 . . . . 0.0 110.22 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.34 -40.02 96.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.135 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.81 -27.1 64.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.998 0.427 . . . . 0.0 109.85 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.648 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -68.34 -37.87 80.94 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.824 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.12 -61.31 5.47 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.21 -29.51 76.02 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.961 2.441 . . . . 0.0 111.682 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.45 -40.5 91.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.172 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.143 179.211 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.466 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.1 t0 68.24 82.53 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.534 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.93 -14.69 40.9 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.74 -121.44 0.3 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.341 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 123' ' ' GLN . 3.2 m -62.78 143.54 15.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 122.078 -0.389 . . . . 0.0 110.482 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 98.7 t -119.34 131.06 73.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.985 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.41 ' O ' ' HB1' ' A' ' 95' ' ' ALA . 0.4 OUTLIER -69.89 141.76 53.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.204 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.482 ' H ' ' HA ' ' A' ' 121' ' ' LYS . 19.2 t -139.94 132.77 15.04 Favored Pre-proline 0 N--CA 1.444 -0.733 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.484 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.406 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 31.1 Cg_endo -63.06 -9.59 17.58 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 121.384 1.389 . . . . 0.0 112.798 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.495 HG11 ' NE2' ' A' ' 85' ' ' HIS . 6.5 t -94.56 -61.04 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.4 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 11.0 p -99.05 -27.13 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.782 0.325 . . . . 0.0 110.983 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.482 ' HA ' ' H ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER 57.5 31.7 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 179.336 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -168.25 136.69 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.451 ' O ' HG12 ' A' ' 114' ' ' VAL . 2.6 mm-40 -142.3 123.53 14.68 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.52 179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 91.8 m -61.79 -44.33 97.09 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -144.12 177.18 8.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.635 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.459 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -121.0 63.75 0.87 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.273 0.558 . . . . 0.0 111.582 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -89.14 -30.0 18.93 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.507 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.2 23.14 13.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 111.535 -178.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.459 HD13 ' HB2' ' A' ' 126' ' ' SER . 10.6 pt -64.69 -169.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.35 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.643 HG13 HD23 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -35.59 104.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 O-C-N 123.924 0.765 . . . . 0.0 110.578 -179.674 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 172.54 -34.2 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 124.135 0.897 . . . . 0.0 110.599 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -83.99 70.18 10.42 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.808 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -97.39 33.0 2.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.843 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -58.65 -48.24 81.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.9 mmt -70.1 143.68 52.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.73 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -160.43 31.06 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.39 0.614 . . . . 0.0 110.501 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -98.0 162.06 13.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.523 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 90.9 p . . . . . 0 N--CA 1.453 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -90.12 31.16 1.01 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.827 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.638 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -63.03 -12.34 25.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.443 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.458 HD23 ' HG3' ' A' ' 63' ' ' GLU . 38.6 mt -49.41 -23.16 1.38 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.989 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -59.24 -44.43 92.35 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.835 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.9 -41.78 5.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -162.81 -87.55 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.638 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 168.36 -80.06 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.765 0.666 . . . . 0.0 111.269 179.788 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -113.79 164.05 14.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.163 0.506 . . . . 0.0 110.149 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.451 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 13.6 t -79.41 138.58 37.68 Favored 'General case' 0 C--O 1.211 -0.929 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.851 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.67 -35.82 81.45 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.741 -0.266 . . . . 0.0 112.747 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.2 t -59.09 -43.8 90.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 9.9 p -109.5 -18.43 13.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.837 0.351 . . . . 0.0 111.587 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 64.93 30.19 12.05 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.933 178.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -119.7 148.58 43.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.282 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -54.27 150.83 8.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.626 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 78' ' ' PRO . 57.7 mt -80.48 105.54 11.81 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.696 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.445 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 2.9 ptm180 -80.83 167.13 34.68 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.165 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -52.29 -46.83 30.29 Favored 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 122.607 2.204 . . . . 0.0 113.033 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.7 mt-10 -82.8 0.07 45.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.204 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.21 -24.46 64.94 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 47.14 73.09 1.06 Allowed Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.283 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.494 ' HB3' HD13 ' A' ' 72' ' ' LEU . 46.9 Cg_endo -68.36 147.9 72.69 Favored 'Trans proline' 0 C--N 1.299 -2.063 0 C-N-CA 122.711 2.274 . . . . 0.0 112.008 -179.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.85 156.08 45.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.792 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.4 tp -106.88 127.33 53.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.27 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.575 HD11 HD22 ' A' ' 92' ' ' LEU . 2.5 mp -86.39 167.06 24.8 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.023 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.69 -20.32 64.86 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.984 2.456 . . . . 0.0 112.224 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 7.2 p -89.64 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.63 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 73.02 50.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.994 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.509 ' CE1' HG11 ' A' ' 119' ' ' VAL . 51.9 m170 -128.97 124.4 34.92 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.868 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -85.79 132.89 34.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.767 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -151.16 165.54 33.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.043 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.437 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -71.11 136.75 48.36 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.822 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.8 t -53.95 -43.29 69.74 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.031 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.28 -39.16 89.39 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.3 m -68.09 -33.65 74.93 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.241 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.767 HD21 ' HB3' ' A' ' 87' ' ' ALA . 84.9 mt -67.19 -28.76 68.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.178 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.402 ' N ' ' HD2' ' A' ' 94' ' ' PRO . . . -53.57 -60.51 8.16 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.392 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 93' ' ' GLY . 30.8 Cg_endo -64.56 -10.34 24.02 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.633 2.222 . . . . 0.0 112.624 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.51 -30.17 66.85 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.789 0.328 . . . . 0.0 110.219 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.437 ' HB2' HG13 ' A' ' 115' ' ' VAL . . . . . . . . 0 CA--C 1.534 0.334 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.449 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.511 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.1 t0 61.16 76.69 0.36 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.831 0.348 . . . . 0.0 110.915 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.77 -17.52 35.76 Favored Glycine 0 CA--C 1.519 0.298 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 77.3 p -115.83 -120.6 0.3 Allowed 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 123' ' ' GLN . 78.4 t -65.0 137.2 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 CA-C-O 120.964 0.411 . . . . 0.0 110.525 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.533 HG21 HG21 ' A' ' 129' ' ' ILE . 96.8 t -106.48 142.41 19.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.408 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -84.87 114.73 22.32 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.478 0.656 . . . . 0.0 111.009 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.4 t -104.56 132.97 20.44 Favored Pre-proline 0 C--O 1.206 -1.229 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.216 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.11 -16.3 26.72 Favored 'Trans proline' 0 C--N 1.297 -2.15 0 C-N-CA 121.216 1.278 . . . . 0.0 112.626 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.509 HG11 ' CE1' ' A' ' 85' ' ' HIS . 16.4 t -96.39 -51.72 10.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.35 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -31.7 11.67 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.953 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 117' ' ' CYS . 3.0 mptt 59.46 22.82 11.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.12 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -172.8 97.86 0.13 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.233 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.588 ' O ' HG13 ' A' ' 114' ' ' VAL . 28.6 mm100 -89.52 145.81 25.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 0.0 110.374 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 88.5 m -61.03 -46.52 90.41 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.498 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -145.93 178.0 8.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.918 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.543 ' HA ' HG23 ' A' ' 129' ' ' ILE . 1.2 p -116.28 36.85 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.48 0.657 . . . . 0.0 111.64 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -89.65 -31.22 17.62 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.623 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -108.86 20.75 18.1 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.656 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.543 HG23 ' HA ' ' A' ' 126' ' ' SER . 24.2 pt -71.25 -169.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.524 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -37.68 108.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 O-C-N 123.8 0.688 . . . . 0.0 110.12 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 164.74 -31.57 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 124.818 1.324 . . . . 0.0 111.321 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -93.47 85.87 5.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.958 -0.697 . . . . 0.0 111.29 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -93.19 137.38 32.57 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.909 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -94.85 -75.78 0.51 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.815 0.34 . . . . 0.0 110.51 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 28.1 ttt -146.02 142.54 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -83.93 64.98 8.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.355 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.64 122.34 13.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.173 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.792 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.78 0.324 . . . . 0.0 110.602 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -90.8 28.81 1.45 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.724 0.774 . . . . 0.0 110.681 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.659 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.55 -11.99 19.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.409 HD23 ' HG3' ' A' ' 63' ' ' GLU . 36.5 mt -48.58 -23.59 1.05 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.277 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.97 -43.35 91.32 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.0 110.594 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.442 HD11 ' CG ' ' A' ' 134' ' ' PHE . 69.9 mt -104.6 -41.06 5.8 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.022 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.23 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.659 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 165.45 -78.13 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.117 0 O-C-N 123.953 0.783 . . . . 0.0 110.75 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.5 p-80 -107.88 165.98 11.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 110.824 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.543 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 13.3 t -81.12 137.14 35.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.563 -179.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.81 -37.98 93.92 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.676 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.488 HG22 ' HG3' ' A' ' 118' ' ' PRO . 73.1 t -59.93 -40.81 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 8.4 p -112.64 -18.63 12.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.943 0.401 . . . . 0.0 111.109 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.32 39.62 9.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.309 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.49 146.79 50.71 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.216 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -55.99 144.42 28.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.633 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.521 HD13 ' HB3' ' A' ' 78' ' ' PRO . 80.7 mt -71.19 105.85 3.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.447 -179.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.463 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 3.5 ptm180 -79.93 165.8 44.84 Favored Pre-proline 0 C--N 1.333 -0.133 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.554 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -53.05 -43.53 56.24 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 122.432 2.088 . . . . 0.0 113.31 -177.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.463 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.2 mt-10 -88.15 2.26 52.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -66.01 -24.98 66.87 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.983 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 50.56 69.0 2.87 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 109.791 -179.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.521 ' HB3' HD13 ' A' ' 72' ' ' LEU . 51.2 Cg_endo -68.9 150.81 73.72 Favored 'Trans proline' 0 C--N 1.293 -2.386 0 C-N-CA 122.628 2.219 . . . . 0.0 111.078 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.32 165.49 29.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.673 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp -114.35 130.19 56.67 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.914 0.388 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.516 HD11 HD22 ' A' ' 92' ' ' LEU . 3.7 mp -90.16 164.54 27.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.242 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.51 -6.2 18.6 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.043 2.495 . . . . 0.0 112.33 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.77 0.91 55.33 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.376 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 77.65 41.54 0.13 Allowed 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 123.825 0.703 . . . . 0.0 111.338 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.463 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.4 m170 -135.29 119.85 18.14 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.995 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -86.52 141.64 28.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.9 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.787 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -157.63 166.86 31.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.875 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . 0.47 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -65.77 137.05 56.99 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.9 t -56.72 -42.19 78.76 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.069 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.27 91.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 80.8 m -66.83 -36.25 81.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.204 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.787 HD21 ' HB3' ' A' ' 87' ' ' ALA . 82.0 mt -66.09 -30.55 71.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.27 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.95 -62.35 4.65 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.866 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.38 -17.29 59.37 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.131 1.887 . . . . 0.0 112.05 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.01 -37.28 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.328 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.152 179.603 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.427 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.6 t0 73.03 81.65 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.783 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.31 -17.4 40.48 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 75.6 p -115.7 -122.16 0.29 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.9 m -63.3 142.91 16.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.807 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.535 HG23 ' OG ' ' A' ' 126' ' ' SER . 56.4 t -113.63 140.72 32.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.421 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -87.74 129.25 35.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.537 0.684 . . . . 0.0 109.913 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.0 t -116.12 131.41 23.78 Favored Pre-proline 0 C--O 1.195 -1.765 0 CA-C-N 114.805 -1.088 . . . . 0.0 108.226 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.488 ' HG3' HG22 ' A' ' 67' ' ' VAL . 23.9 Cg_endo -59.6 -11.5 14.44 Favored 'Trans proline' 0 C--N 1.295 -2.25 0 CA-C-N 121.502 1.572 . . . . 0.0 113.176 -178.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.463 HG11 ' NE2' ' A' ' 85' ' ' HIS . 21.4 t -84.01 -44.82 18.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.541 -0.463 . . . . 0.0 111.7 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.55 -30.69 5.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.02 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.2 OUTLIER 64.24 31.44 13.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.073 178.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -162.72 139.43 7.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.996 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -143.05 161.49 38.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.077 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 80.4 m -96.48 -43.16 7.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.998 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -142.34 175.05 10.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.251 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.535 ' OG ' HG23 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -125.06 42.71 3.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.336 0.588 . . . . 0.0 111.217 179.6 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -85.75 -15.45 42.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.031 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -114.33 22.48 13.69 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.6 pt -69.12 -173.65 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.774 0.321 . . . . 0.0 111.144 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.462 HG12 HD12 ' A' ' 92' ' ' LEU . 2.3 m -45.47 105.61 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.284 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.572 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 168.26 -32.16 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 124.152 0.908 . . . . 0.0 110.576 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -93.31 64.95 3.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.154 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -60.83 139.37 57.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.394 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . 0.442 ' CG ' HD11 ' A' ' 61' ' ' LEU . 80.7 t80 -93.56 -72.95 0.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.485 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.7 ttt -150.79 144.86 25.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.596 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -122.48 99.69 6.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -135.75 34.6 2.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.696 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 15.5 m . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.246 0 CA-C-O 120.794 0.331 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.1 mp0 -94.41 30.26 2.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.77 0.795 . . . . 0.0 110.148 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.8 -11.98 15.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.447 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.425 HD23 ' HG3' ' A' ' 63' ' ' GLU . 43.8 mt -47.51 -24.07 0.77 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.309 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -58.98 -41.74 88.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.331 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 mp -104.42 -40.91 5.9 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.934 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.55 -85.49 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 164.7 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 O-C-N 124.136 0.898 . . . . 0.0 110.905 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.88 162.37 14.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.306 0.574 . . . . 0.0 110.699 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 30.5 t -73.31 134.9 44.31 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.544 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.5 -30.07 71.28 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.775 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.1 t -64.11 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.06 -15.47 11.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 110.972 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.33 41.09 8.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.254 0.55 . . . . 0.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -126.19 144.97 50.57 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.196 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -52.57 151.98 3.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.64 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.3 mt -85.87 102.28 13.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.017 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -75.9 160.22 79.14 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.854 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -57.59 -33.16 96.15 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.161 1.907 . . . . 0.0 111.319 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -89.03 -8.17 54.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.449 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -67.78 -24.33 65.31 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.911 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 51.09 73.6 0.95 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.479 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.04 149.43 71.49 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.706 2.27 . . . . 0.0 111.739 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.423 ' CZ ' HG23 ' A' ' 130' ' ' VAL . 96.0 mtt180 -141.54 141.58 33.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.306 -178.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.8 tp -92.65 129.22 38.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.47 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -85.59 165.37 35.81 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.27 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -62.68 -18.33 63.5 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.175 2.583 . . . . 0.0 112.34 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.64 2.7 55.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.103 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.7 47.68 0.12 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.206 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -133.91 124.75 26.94 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.472 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.9 m -85.06 138.49 32.4 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.987 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.594 ' HB3' HD12 ' A' ' 92' ' ' LEU . . . -147.98 160.88 42.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.314 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 6.3 m -62.67 151.83 37.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.5 t -58.74 -47.56 84.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.985 0.422 . . . . 0.0 110.582 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.79 -42.44 95.05 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.817 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.8 m -67.07 -23.72 65.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.204 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.594 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -64.56 -32.11 73.62 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.126 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.49 -65.14 3.44 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 95' ' ' ALA . 22.0 Cg_exo -64.37 110.5 1.4 Allowed 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.689 2.26 . . . . 0.0 111.492 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.669 ' HB1' ' O ' ' A' ' 116' ' ' ASP . . . 169.56 -71.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.629 0.581 . . . . 0.0 110.057 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.742 ' HB2' HG22 ' A' ' 115' ' ' VAL . . . . . . . . 0 CA--C 1.54 0.559 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.919 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.501 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.37 73.55 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.026 0.441 . . . . 0.0 110.628 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 102.98 -13.44 56.06 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.0 p -114.68 -118.94 0.31 Allowed 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.428 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.7 m -61.3 141.83 16.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.742 HG22 ' HB2' ' A' ' 96' ' ' ALA . 58.5 t -107.74 134.01 50.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.117 -178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.669 ' O ' ' HB1' ' A' ' 95' ' ' ALA . 15.8 t70 -81.37 108.66 15.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.968 0.889 . . . . 0.0 110.54 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 121' ' ' LYS . 36.6 t -95.83 131.76 28.55 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.787 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.97 -12.07 14.21 Favored 'Trans proline' 0 C--N 1.297 -2.147 0 C-N-CA 121.003 1.136 . . . . 0.0 112.771 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.44 -61.58 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.504 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 9.3 p -98.7 -25.35 14.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.953 0.406 . . . . 0.0 110.85 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.7 mptt 55.74 32.66 19.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -165.27 137.47 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.03 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -144.6 142.08 29.9 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 98.7 m -70.86 -44.63 66.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.011 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -145.49 178.07 8.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.711 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.54 48.86 1.52 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.481 0.658 . . . . 0.0 111.516 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.01 -29.7 21.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.282 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -103.86 20.49 18.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.904 0.383 . . . . 0.0 111.392 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.6 pt -62.9 -168.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.483 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -35.31 116.5 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 O-C-N 124.054 0.846 . . . . 0.0 110.437 -179.756 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 161.63 -32.52 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.465 0 O-C-N 124.986 1.429 . . . . 0.0 110.013 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -85.59 60.02 5.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.228 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -97.25 28.59 3.56 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.473 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -59.48 -48.04 83.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.6 mmt -78.83 121.1 24.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.237 0.541 . . . . 0.0 110.844 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -153.35 104.34 2.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.22 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -108.4 -80.93 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.133 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 18.6 p . . . . . 0 C--N 1.333 -0.117 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.339 179.634 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.065 0.46 . . . . 0.0 109.799 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.96 19.82 1.31 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.093 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.652 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -59.81 -12.67 7.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.632 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.414 HD23 ' HG3' ' A' ' 63' ' ' GLU . 44.3 mt -47.93 -24.02 0.93 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.461 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -59.39 -41.58 89.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.067 0.46 . . . . 0.0 110.382 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -104.0 -40.43 6.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.869 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.35 -86.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.652 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.5 mt-10 164.29 -78.95 0.0 OUTLIER 'General case' 0 CA--C 1.527 0.064 0 O-C-N 124.037 0.835 . . . . 0.0 110.823 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -106.17 163.09 13.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.315 0.579 . . . . 0.0 110.72 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -76.73 135.1 39.02 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.216 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.86 -37.94 94.93 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.634 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.494 HG22 ' HG2' ' A' ' 118' ' ' PRO . 78.2 t -60.41 -40.32 83.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -176.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 7.7 p -113.07 -17.79 12.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.956 0.408 . . . . 0.0 110.939 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.23 41.31 8.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.368 179.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -129.76 147.8 51.57 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.161 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.8 tpp85 -54.26 144.74 19.39 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.941 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.9 mt -75.53 102.85 5.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.24 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -78.83 164.28 56.13 Favored Pre-proline 0 C--N 1.331 -0.207 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.86 -48.28 17.23 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 C-N-CA 121.44 1.427 . . . . 0.0 112.668 -178.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -72.2 -4.87 31.89 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.968 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -67.34 -25.14 65.85 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.777 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 51.78 72.11 1.3 Allowed Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.255 -178.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.81 148.2 76.57 Favored 'Trans proline' 0 C--N 1.297 -2.157 0 C-N-CA 122.711 2.274 . . . . 0.0 112.102 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -139.52 160.89 38.8 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.161 -178.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.2 tp -115.31 127.85 55.71 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.013 0.435 . . . . 0.0 111.019 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.3 mp -87.39 164.59 34.75 Favored Pre-proline 0 N--CA 1.467 0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.097 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.57 -6.67 19.63 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 123.061 2.508 . . . . 0.0 112.408 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -94.5 0.1 55.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 78.33 41.67 0.11 Allowed 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.947 0.779 . . . . 0.0 111.221 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.465 ' CD2' HG11 ' A' ' 119' ' ' VAL . 33.8 m170 -134.79 123.94 24.36 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.515 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.5 m -86.83 143.49 27.45 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.828 -0.749 . . . . 0.0 109.719 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.64 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -150.49 164.48 35.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.992 -179.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 21.1 m -66.85 151.08 48.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.181 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.3 p -61.8 -42.24 98.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.616 0.722 . . . . 0.0 109.878 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.46 95.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.268 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.92 -31.85 69.83 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.775 0.798 . . . . 0.0 109.963 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.64 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -63.46 -37.14 86.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.429 -179.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.64 -62.31 4.94 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 120.508 -0.853 . . . . 0.0 111.203 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.21 -22.6 66.89 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 122.08 1.854 . . . . 0.0 111.467 179.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.65 -38.9 82.67 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.934 179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.473 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.962 178.969 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.605 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.6 t0 74.57 83.24 0.11 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.895 0.409 . . . . 0.0 111.957 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.3 -9.44 45.78 Favored Glycine 0 CA--C 1.519 0.294 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.1 t -116.69 -118.57 0.32 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.33 151.53 4.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.358 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.7 t -112.71 135.36 52.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.099 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -77.62 104.22 8.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.55 0.69 . . . . 0.0 109.553 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 121' ' ' LYS . 13.1 t -100.13 116.99 64.02 Favored Pre-proline 0 C--O 1.204 -1.296 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.637 -179.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.494 ' HG2' HG22 ' A' ' 67' ' ' VAL . 38.6 Cg_exo -53.2 -16.06 6.24 Favored 'Trans proline' 0 C--N 1.297 -2.142 0 CA-C-N 121.068 1.417 . . . . 0.0 113.47 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.465 HG11 ' CD2' ' A' ' 85' ' ' HIS . 23.3 t -79.03 -62.11 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.742 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.8 p -99.73 -29.13 12.82 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.463 0.649 . . . . 0.0 109.826 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.429 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.4 OUTLIER 63.94 33.1 12.69 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.22 178.78 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -164.63 138.6 5.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.998 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -145.4 165.57 28.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.993 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.3 m -95.92 -50.99 4.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.357 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -142.45 176.24 9.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.736 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.37 34.48 4.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.428 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.5 ptmt -77.18 -22.53 52.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.21 22.3 14.91 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.448 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 45.5 pt -65.98 -168.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -36.39 115.32 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 O-C-N 124.066 0.854 . . . . 0.0 110.666 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 164.19 -31.76 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 124.914 1.384 . . . . 0.0 109.871 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -86.14 60.19 6.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.934 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -91.31 36.96 0.93 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.712 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.87 -48.4 81.52 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.235 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.0 mmt -84.49 139.32 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.071 0.462 . . . . 0.0 111.029 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -148.35 48.58 1.04 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.508 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.07 159.28 15.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.534 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.3 p . . . . . 0 C--N 1.33 -0.272 0 CA-C-O 120.821 0.344 . . . . 0.0 110.949 -179.623 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.597 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 155.06 -164.99 32.08 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.2 140.33 41.67 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -89.39 37.42 0.86 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 110.504 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.63 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -63.44 -12.32 30.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.773 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.466 HD23 ' HG3' ' A' ' 63' ' ' GLU . 37.5 mt -49.66 -23.11 1.56 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.125 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -59.46 -44.26 93.03 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.872 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 71.5 mt -104.74 -41.28 5.7 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.621 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.56 -88.04 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.63 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 167.33 -78.92 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.081 0 O-C-N 123.706 0.629 . . . . 0.0 110.92 179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -114.12 167.02 11.04 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.243 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.437 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.5 t -78.24 135.29 37.55 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.49 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.06 -38.71 94.29 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 121.564 -0.35 . . . . 0.0 113.068 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.08 -43.35 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.2 p -107.11 -18.74 13.81 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.865 0.364 . . . . 0.0 111.605 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 63.47 40.28 8.42 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.294 0.568 . . . . 0.0 110.491 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -130.84 146.77 52.37 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.175 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -52.17 149.23 5.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.601 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.44 HD23 ' HG2' ' A' ' 76' ' ' ARG . 73.6 mt -79.57 105.83 11.16 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.714 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -85.39 167.25 26.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.94 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.69 -51.57 10.82 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.476 1.451 . . . . 0.0 112.625 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.25 -5.03 33.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.522 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.44 ' HG2' HD23 ' A' ' 72' ' ' LEU . 1.6 tpm_? -66.67 -26.12 66.89 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.838 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 46.71 70.06 2.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 O-C-N 123.584 0.553 . . . . 0.0 109.614 -178.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.423 ' HB3' HD13 ' A' ' 72' ' ' LEU . 36.3 Cg_endo -66.18 145.06 77.47 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.923 2.415 . . . . 0.0 111.697 -178.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -141.93 143.72 33.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.37 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.94 123.51 45.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.839 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.486 HD11 HD22 ' A' ' 92' ' ' LEU . 6.5 mp -83.55 168.19 23.81 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.605 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.471 ' CD ' HD12 ' A' ' 129' ' ' ILE . 11.8 Cg_exo -68.17 -14.57 40.96 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 123.154 2.569 . . . . 0.0 112.28 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.2 p -88.48 -0.77 57.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.237 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 75.52 46.37 0.11 Allowed 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 123.832 0.708 . . . . 0.0 111.142 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -134.12 117.53 16.68 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.881 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.0 m -87.59 141.45 28.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.096 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.7 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -156.88 164.59 37.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.805 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.456 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -62.95 137.22 58.21 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.556 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -56.38 -43.18 79.0 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.042 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.12 -40.1 92.51 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.471 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.2 m -67.26 -33.56 75.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.29 0.567 . . . . 0.0 110.308 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.7 HD21 ' HB3' ' A' ' 87' ' ' ALA . 90.4 mt -68.81 -28.64 66.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.64 -62.3 6.36 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.562 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.27 -19.35 42.06 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 123.071 2.514 . . . . 0.0 111.758 178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.12 -37.63 77.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.577 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.66 144.12 51.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.455 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.96 156.43 38.79 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 122.349 2.033 . . . . 0.0 112.422 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.56 134.73 37.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.434 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 47.5 30.78 1.74 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.636 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -152.4 156.0 38.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.712 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -152.72 168.15 26.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.1 t -159.0 145.75 17.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.618 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 64.6 m 51.57 44.14 29.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.79 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -99.67 117.79 5.98 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -62.56 -39.57 94.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.822 0.344 . . . . 0.0 110.615 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.25 163.65 33.0 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.04 -130.23 50.71 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -128.64 141.82 51.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.755 0.312 . . . . 0.0 110.393 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.77 136.89 52.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.792 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 89.26 168.45 43.64 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.8 t0 68.68 82.93 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.788 0.328 . . . . 0.0 110.721 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.39 -17.1 37.4 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 -178.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -116.16 -119.33 0.31 Allowed 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.418 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.4 m -63.17 152.72 7.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.962 0.41 . . . . 0.0 110.096 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.703 ' HB ' HD11 ' A' ' 129' ' ' ILE . 82.8 t -127.98 142.06 44.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.745 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -80.52 125.41 29.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.636 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.7 135.47 19.77 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.331 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.68 -11.14 10.84 Favored 'Trans proline' 0 C--N 1.303 -1.868 0 CA-C-N 120.613 1.255 . . . . 0.0 112.939 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 22.3 t -94.35 -60.86 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.574 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.8 p -98.42 -26.37 14.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.975 0.416 . . . . 0.0 110.543 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mptt 57.64 35.24 25.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.978 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.66 144.81 4.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.918 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.04 153.68 40.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.659 179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 92.7 m -95.69 -44.55 7.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.181 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -142.47 160.12 40.9 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.31 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.88 27.02 7.42 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.577 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -61.55 -41.46 97.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.452 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -105.32 16.37 25.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.327 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.703 HD11 ' HB ' ' A' ' 115' ' ' VAL . 0.2 OUTLIER -77.57 -176.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.133 -179.467 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.524 ' CG1' HD13 ' A' ' 92' ' ' LEU . 2.6 m -38.76 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.956 0.785 . . . . 0.0 109.762 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 161.97 -21.31 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.894 1.371 . . . . 0.0 111.244 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -106.89 30.46 6.11 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.978 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -42.43 118.42 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.321 0.581 . . . . 0.0 111.314 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -63.45 -51.92 63.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 171.03 -168.53 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.395 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -115.82 92.46 3.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.878 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.34 -10.01 55.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.007 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 73.9 p -64.64 156.88 28.7 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.782 0.325 . . . . 0.0 110.4 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -176.03 142.73 6.18 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 67.1 m 49.12 40.72 18.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.742 0.306 . . . . 0.0 110.564 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -93.48 124.2 37.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -152.17 148.36 27.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.0 -40.37 95.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 70.5 p -78.38 164.04 25.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.576 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.691 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.84 -39.92 98.13 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.99 140.31 57.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.751 0.31 . . . . 0.0 110.297 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -90.23 20.3 4.48 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.403 0.62 . . . . 0.0 111.172 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.635 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.52 -12.2 14.21 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.672 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.444 HD23 ' HG3' ' A' ' 63' ' ' GLU . 47.5 mt -49.61 -23.4 1.67 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.281 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -59.66 -42.28 92.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.014 0.435 . . . . 0.0 110.618 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.96 -40.14 6.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.718 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -85.53 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.635 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 167.1 -80.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 O-C-N 123.98 0.8 . . . . 0.0 110.649 179.087 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -109.24 164.67 12.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.55 0.69 . . . . 0.0 110.714 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.501 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 24.1 t -80.22 136.27 36.43 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.092 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.06 -35.6 89.34 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.399 -0.364 . . . . 0.0 112.727 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.75 -39.35 79.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -177.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.4 p -116.59 -17.43 10.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.487 . . . . 0.0 111.409 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.98 40.23 7.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.586 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.99 147.21 50.49 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.161 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -54.26 149.36 9.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.64 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 78' ' ' PRO . 78.2 mt -79.73 109.46 14.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.92 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -73.51 161.41 79.09 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.451 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -57.79 -40.25 80.52 Favored 'Trans proline' 0 N--CA 1.495 1.571 0 C-N-CA 122.261 1.974 . . . . 0.0 111.742 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -89.68 1.25 56.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.223 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.16 -24.8 65.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.943 0.401 . . . . 0.0 111.681 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 70.7 tt0 54.3 71.76 1.27 Allowed Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.137 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HB3' HD13 ' A' ' 72' ' ' LEU . 60.0 Cg_endo -72.0 152.26 57.03 Favored 'Trans proline' 0 C--N 1.293 -2.39 0 C-N-CA 122.752 2.302 . . . . 0.0 111.085 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.443 ' HD2' HG12 ' A' ' 130' ' ' VAL . 0.1 OUTLIER -139.75 166.95 23.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.307 -179.559 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 tp -118.43 126.78 52.79 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.44 HD11 HD22 ' A' ' 92' ' ' LEU . 3.8 mp -85.67 168.53 19.35 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.869 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -67.08 -15.71 47.31 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 123.332 2.688 . . . . 0.0 112.538 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 11.2 p -93.44 1.12 56.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.4 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.02 51.51 0.11 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.38 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.422 ' CE1' HG11 ' A' ' 119' ' ' VAL . 56.2 m170 -128.07 121.46 29.73 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.51 178.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -87.6 132.37 34.09 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.235 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.695 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -150.22 162.04 41.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.803 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -66.51 136.55 55.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -56.57 -42.06 77.96 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.573 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.96 91.59 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.1 m -68.19 -32.99 73.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.239 0.542 . . . . 0.0 110.009 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.695 HD21 ' HB3' ' A' ' 87' ' ' ALA . 93.7 mt -70.78 -26.67 63.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.849 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.66 -60.0 9.78 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.8 -0.715 . . . . 0.0 111.751 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.31 -16.36 34.15 Favored 'Trans proline' 0 N--CA 1.496 1.622 0 C-N-CA 122.95 2.434 . . . . 0.0 111.993 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.3 -38.47 80.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.679 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.88 146.29 99.0 Favored Pre-proline 0 CA--C 1.535 0.385 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.216 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.31 -21.37 31.03 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.47 2.113 . . . . 0.0 112.664 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' ' 99' ' ' ALA . . . 59.36 35.1 23.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.519 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 98' ' ' ALA . . . 67.54 31.55 6.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.683 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -119.31 7.88 11.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.013 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -150.64 125.06 9.52 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.224 0.535 . . . . 0.0 111.155 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 82.2 p -72.13 163.49 27.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.429 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.8 t -109.25 122.53 47.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.869 0.366 . . . . 0.0 110.482 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -66.82 131.02 31.09 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 51.59 28.61 4.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.764 0.316 . . . . 0.0 110.378 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -112.4 -169.85 18.06 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 108' ' ' ALA . . . -60.93 -41.16 99.22 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 107' ' ' GLY . . . 176.2 -56.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.925 0.393 . . . . 0.0 110.724 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.58 162.28 40.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.51 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -77.74 -145.0 2.27 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.5 t0 77.38 87.23 0.08 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.018 0.437 . . . . 0.0 111.37 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.36 -18.09 39.24 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.6 t -116.81 -122.84 0.29 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.45 149.38 9.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.113 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.462 ' HB ' HD11 ' A' ' 129' ' ' ILE . 59.4 t -123.49 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.729 -179.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -67.37 92.01 0.28 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.661 0.743 . . . . 0.0 109.688 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 9.1 t -75.33 132.79 75.48 Favored Pre-proline 0 C--O 1.212 -0.89 0 CA-C-N 114.44 -1.254 . . . . 0.0 108.845 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.98 -14.13 35.4 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 120.803 1.322 . . . . 0.0 112.531 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.422 HG11 ' CE1' ' A' ' 85' ' ' HIS . 6.6 t -94.75 -50.37 11.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 120.296 -0.562 . . . . 0.0 112.414 -178.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.57 -29.27 10.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.377 0.608 . . . . 0.0 110.095 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.4 mptt 57.48 29.51 17.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.828 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -170.31 100.76 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.523 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -100.47 143.48 30.61 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.175 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.43 -54.29 25.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.564 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -145.18 171.69 14.17 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.121 0.486 . . . . 0.0 110.798 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.565 ' O ' HG22 ' A' ' 129' ' ' ILE . 13.7 p -93.57 8.78 39.44 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.552 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.87 -40.95 97.74 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.474 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -101.17 9.86 41.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.627 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.565 HG22 ' O ' ' A' ' 126' ' ' SER . 0.4 OUTLIER -86.15 -172.1 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.655 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.541 ' CG1' HD13 ' A' ' 92' ' ' LEU . 2.6 m -39.32 104.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 O-C-N 123.504 0.503 . . . . 0.0 110.983 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 162.86 -25.02 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 125.022 1.451 . . . . 0.0 110.56 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -104.6 57.55 0.7 Allowed 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.43 -177.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 6.4 p90 -52.38 141.37 19.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.302 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -102.18 -74.97 0.61 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.368 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.1 ttt -151.26 144.43 24.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.726 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -83.92 62.63 7.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.837 0.351 . . . . 0.0 110.182 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -61.5 139.8 58.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.157 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 6.0 p 176.72 -26.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 124.49 -49.91 0.88 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 72.1 m -63.49 -39.97 95.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.183 0.516 . . . . 0.0 110.253 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -101.58 125.82 48.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.711 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.63 150.97 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.429 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -64.53 137.43 57.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 67.4 p -71.42 -26.31 62.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.708 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.681 -179.788 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.599 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.3 -41.81 99.73 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.031 -0.827 . . . . 0.0 111.031 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.91 130.67 35.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.832 0.349 . . . . 0.0 110.19 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -89.33 21.34 3.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.253 0.549 . . . . 0.0 110.947 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.622 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.12 -12.23 18.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.674 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.407 HD23 ' HG3' ' A' ' 63' ' ' GLU . 31.5 mt -49.73 -22.31 1.35 Allowed 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.222 179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.02 -44.45 91.73 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.822 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 mt -104.81 -41.47 5.63 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.513 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.34 -89.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.622 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.2 mt-10 165.41 -79.99 0.0 OUTLIER 'General case' 0 N--CA 1.461 0.107 0 O-C-N 123.879 0.737 . . . . 0.0 110.799 179.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -106.42 165.74 11.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.181 0.515 . . . . 0.0 110.319 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.441 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 18.9 t -80.02 137.03 36.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.764 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.08 -34.99 82.8 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 121.658 -0.306 . . . . 0.0 112.796 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.99 -42.32 89.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.1 p -111.25 -18.6 12.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.975 0.417 . . . . 0.0 111.234 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 64.17 38.56 8.16 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -128.03 144.32 51.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.207 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 149.37 2.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.395 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.0 mt -78.97 106.9 11.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.641 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.05 157.98 86.28 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.52 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.82 -38.45 95.8 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 121.985 1.79 . . . . 0.0 111.369 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -87.92 -0.59 57.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.308 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.55 -24.67 65.55 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 120.742 0.306 . . . . 0.0 111.703 -179.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 56.56 70.02 1.58 Allowed Pre-proline 0 N--CA 1.442 -0.842 0 CA-C-O 121.405 0.621 . . . . 0.0 109.943 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.91 147.6 74.8 Favored 'Trans proline' 0 C--N 1.301 -1.948 0 C-N-CA 123.052 2.501 . . . . 0.0 111.485 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 mtm-85 -138.02 161.24 37.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.587 -179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.5 tp -116.97 124.77 50.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.037 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.565 HD11 HD22 ' A' ' 92' ' ' LEU . 5.2 mp -87.99 162.8 39.89 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.414 179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.74 -8.9 24.79 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 123.066 2.511 . . . . 0.0 112.419 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 22.1 p -92.44 2.42 56.68 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.067 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 73.9 41.68 0.4 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.488 0.661 . . . . 0.0 110.989 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -133.32 118.79 18.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.4 m -86.89 139.06 31.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.09 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.704 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -151.66 165.19 35.12 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.848 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.431 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -70.88 139.35 50.77 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 t -54.65 -43.41 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.237 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -40.08 92.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.6 m -67.78 -34.73 77.36 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.49 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.704 HD21 ' HB3' ' A' ' 87' ' ' ALA . 82.1 mt -64.93 -31.46 72.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.974 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.7 -63.07 4.4 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.469 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.25 -15.2 46.72 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 122.484 2.122 . . . . 0.0 112.321 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.51 -36.3 75.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.519 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.22 123.0 87.86 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.323 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.52 155.82 58.95 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.072 1.848 . . . . 0.0 112.454 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -144.89 155.53 43.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.515 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 133.24 55.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 0.0 110.525 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.46 -40.32 96.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.791 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -113.38 151.67 30.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.649 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 48.2 t -60.49 -42.6 96.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.428 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 82.7 p -69.85 161.29 30.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.642 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -89.78 12.36 67.51 Favored Glycine 0 CA--C 1.528 0.901 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -60.28 -39.53 87.2 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.677 0.275 . . . . 0.0 110.707 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -96.82 146.24 18.2 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.85 163.2 54.89 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.66 154.05 39.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.846 0.355 . . . . 0.0 110.586 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -115.97 145.35 43.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.529 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 60.24 -129.26 47.38 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 t0 70.87 74.46 0.19 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.848 0.356 . . . . 0.0 110.937 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.17 -17.43 37.61 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 -178.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 66.7 p -115.44 -119.31 0.31 Allowed 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.484 0.183 . . . . 0.0 110.513 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.432 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.3 m -59.13 141.97 15.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.214 0.531 . . . . 0.0 110.516 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.9 139.62 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.591 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -84.58 108.18 17.2 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.331 0.586 . . . . 0.0 110.281 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.404 ' HB3' ' SG ' ' A' ' 120' ' ' CYS . 1.6 t -96.61 135.92 22.05 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.414 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -55.16 -18.05 16.78 Favored 'Trans proline' 0 C--N 1.297 -2.144 0 C-N-CA 121.072 1.181 . . . . 0.0 112.86 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.64 -63.09 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.006 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.404 ' SG ' ' HB3' ' A' ' 117' ' ' CYS . 22.4 p -87.62 -28.44 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.91 0.386 . . . . 0.0 110.86 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 50.53 25.0 1.79 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.851 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -166.53 122.7 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.845 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -123.91 143.09 50.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.732 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . 0.416 ' HG ' ' HD2' ' A' ' 125' ' ' PHE . 50.8 t -63.47 -51.08 67.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.907 0.384 . . . . 0.0 110.721 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.416 ' HD2' ' HG ' ' A' ' 124' ' ' CYS . 2.5 p90 -146.4 176.02 10.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.341 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.519 ' HA ' HG23 ' A' ' 129' ' ' ILE . 59.5 p -108.04 53.56 0.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.775 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -87.42 -40.39 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.742 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.5 22.82 13.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 111.581 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.519 HG23 ' HA ' ' A' ' 126' ' ' SER . 1.7 pt -62.87 -171.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.432 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.3 OUTLIER -37.9 109.43 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 O-C-N 123.901 0.751 . . . . 0.0 110.393 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 167.96 -30.78 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 124.793 1.308 . . . . 0.0 111.014 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -84.88 72.65 10.75 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 120.296 -0.561 . . . . 0.0 111.068 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -93.39 26.93 2.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -59.93 -47.78 84.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.942 0.401 . . . . 0.0 110.514 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.4 tpt -73.95 125.96 29.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.812 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -144.62 96.35 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.818 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -124.23 144.44 49.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.605 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 p -177.56 -75.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.917 0.389 . . . . 0.0 111.007 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -99.03 73.09 0.53 Allowed Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 13.5 p 51.51 34.27 12.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.796 0.331 . . . . 0.0 110.294 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -82.0 105.63 13.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.617 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -71.03 148.45 47.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.671 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -121.03 141.8 50.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.572 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 89.8 m -66.29 130.29 42.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.499 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.536 179.902 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.636 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 103.45 119.09 4.56 Favored Glycine 0 CA--C 1.521 0.416 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.4 144.38 53.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.912 0.387 . . . . 0.0 110.202 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -87.94 22.08 2.48 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.555 0.693 . . . . 0.0 111.051 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.604 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.77 -12.22 16.0 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.777 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.437 HD23 ' HG3' ' A' ' 63' ' ' GLU . 44.2 mt -49.46 -22.97 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.181 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.71 -42.9 94.07 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.535 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.7 mt -103.92 -40.29 6.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.639 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.28 -86.6 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.604 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 166.94 -78.38 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 O-C-N 123.906 0.754 . . . . 0.0 110.904 179.426 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -106.71 164.58 11.97 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.351 0.596 . . . . 0.0 110.438 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.2 t -80.94 137.11 36.12 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.869 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.35 -36.11 88.72 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 121.778 -0.248 . . . . 0.0 112.799 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.697 HG22 ' HG2' ' A' ' 118' ' ' PRO . 61.5 t -59.46 -40.04 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 5.6 p -114.19 -18.3 11.66 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.915 0.388 . . . . 0.0 111.128 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 64.14 38.35 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.347 0.594 . . . . 0.0 110.664 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -127.14 144.4 51.04 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.844 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -51.87 150.87 3.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.715 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.542 HD13 ' HB3' ' A' ' 78' ' ' PRO . 92.3 mt -78.02 105.11 9.01 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.298 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -79.24 166.89 38.74 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.94 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.31 -47.82 24.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 C-N-CA 122.046 1.831 . . . . 0.0 112.982 -177.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -82.2 2.8 29.98 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.508 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.444 ' HG2' HD23 ' A' ' 72' ' ' LEU . 6.4 tpm_? -63.94 -25.76 68.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.311 -178.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.447 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 79.3 tt0 50.73 65.96 6.08 Favored Pre-proline 0 N--CA 1.446 -0.66 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.581 -178.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.542 ' HB3' HD13 ' A' ' 72' ' ' LEU . 22.6 Cg_exo -62.48 150.19 88.33 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 123.161 2.574 . . . . 0.0 112.279 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mtt85 -149.66 147.24 27.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.155 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.04 114.37 28.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.924 0.392 . . . . 0.0 111.264 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -66.37 165.25 24.58 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 121.066 0.46 . . . . 0.0 110.944 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -63.63 -14.71 44.32 Favored 'Trans proline' 0 C--N 1.303 -1.844 0 C-N-CA 123.091 2.527 . . . . 0.0 112.392 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 18.5 p -90.5 2.87 55.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.352 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 75.41 47.94 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.835 0.71 . . . . 0.0 111.373 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -129.95 121.16 26.03 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.649 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -86.77 133.29 33.67 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.122 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.62 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -154.13 167.15 30.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.646 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -69.11 149.73 48.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.342 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.5 t -58.88 -44.43 91.12 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.077 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.45 97.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.881 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.3 m -70.0 -28.05 65.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.658 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.62 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.5 OUTLIER -69.09 -34.31 74.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.375 179.478 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.447 ' O ' ' HB3' ' A' ' 99' ' ' ALA . . . -51.1 -57.97 10.39 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 120.745 -0.74 . . . . 0.0 111.97 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.92 -11.87 23.27 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.053 1.836 . . . . 0.0 112.832 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.15 -37.44 80.15 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.014 0.435 . . . . 0.0 110.395 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -93.44 147.39 33.61 Favored Pre-proline 0 C--O 1.236 0.392 0 C-N-CA 120.147 -0.621 . . . . 0.0 110.788 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.85 -34.15 24.79 Favored 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.056 1.837 . . . . 0.0 112.423 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.706 ' HB2' ' OD1' ' A' ' 111' ' ' ASP . . . -62.96 -44.88 94.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.598 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 93' ' ' GLY . . . -63.79 -41.79 97.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.622 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.19 158.81 40.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.656 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -84.45 102.59 12.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.319 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.7 t -65.26 137.43 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 70.1 m -89.57 154.11 20.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.51 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 84.17 -169.49 45.97 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.48 102.5 14.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 179.75 170.84 41.98 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.05 21.5 78.36 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.981 -0.847 . . . . 0.0 110.981 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.42 135.77 57.16 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.549 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 47.1 29.64 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.683 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -86.61 -155.46 27.08 Favored Glycine 0 CA--C 1.521 0.451 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.706 ' OD1' ' HB2' ' A' ' 98' ' ' ALA . 19.3 t0 73.43 82.38 0.12 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.013 0.435 . . . . 0.0 111.774 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.29 -18.65 35.63 Favored Glycine 0 C--N 1.332 0.332 0 N-CA-C 110.404 -1.079 . . . . 0.0 110.404 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.2 t -117.67 -119.99 0.31 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.307 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 123' ' ' GLN . 3.2 m -61.21 155.32 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.941 0.4 . . . . 0.0 110.893 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 73.8 t -119.78 140.1 44.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -84.97 109.3 18.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.811 0.815 . . . . 0.0 111.165 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.1 t -103.5 130.95 22.57 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 114.385 -1.28 . . . . 0.0 109.552 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.697 ' HG2' HG22 ' A' ' 67' ' ' VAL . 36.7 Cg_exo -55.15 -15.4 10.58 Favored 'Trans proline' 0 C--N 1.302 -1.878 0 C-N-CA 121.236 1.291 . . . . 0.0 112.956 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.3 t -92.49 -62.54 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.34 -0.544 . . . . 0.0 112.148 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.6 p -95.49 -26.38 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.565 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 mptt 53.93 24.56 4.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.674 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 tm0? -162.82 128.61 3.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.607 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.411 ' O ' HG12 ' A' ' 114' ' ' VAL . 1.3 mm100 -136.59 139.06 41.86 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . 0.437 ' HG ' ' HD2' ' A' ' 125' ' ' PHE . 53.0 t -61.44 -49.4 76.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 110.295 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.437 ' HD2' ' HG ' ' A' ' 124' ' ' CYS . 5.7 p90 -145.04 177.06 9.04 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.415 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 3.8 p -122.29 48.37 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.278 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -87.15 -22.9 25.04 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.992 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -109.13 18.34 20.67 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.872 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.8 pt -64.06 -169.83 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.812 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.491 HG13 HD23 ' A' ' 92' ' ' LEU . 2.5 m -39.05 104.32 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.281 0 O-C-N 123.867 0.729 . . . . 0.0 110.237 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 162.91 -13.24 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 124.735 1.272 . . . . 0.0 111.427 -178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -90.85 20.33 4.87 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 119.752 -0.779 . . . . 0.0 111.116 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -42.09 105.77 0.05 Allowed 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.54 0.525 . . . . 0.0 110.952 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -85.05 -74.4 0.4 Allowed 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 55.0 ttp -152.83 148.61 27.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.483 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 78.3 mtm-85 -86.28 65.6 9.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.141 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -55.41 125.27 20.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.783 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 p -179.54 96.63 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.781 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 67.88 24.33 74.3 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 62.9 m 57.26 19.38 4.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.695 0.283 . . . . 0.0 110.643 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.95 -40.08 91.01 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.909 0.385 . . . . 0.0 110.862 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -71.07 149.26 46.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.861 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 60.96 45.73 9.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.583 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 98.1 m -63.57 131.0 46.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.576 -179.694 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.713 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.95 99.87 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.47 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . -64.22 139.38 58.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 0.0 110.585 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.84 20.23 4.94 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.499 0.666 . . . . 0.0 110.651 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.87 -11.68 14.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.819 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.426 HD23 ' HG3' ' A' ' 63' ' ' GLU . 45.8 mt -48.27 -23.51 0.91 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.894 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.53 -44.01 93.29 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.713 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 67.2 mt -104.44 -41.83 5.63 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.716 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.81 -89.99 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.7 OUTLIER 165.27 -67.72 0.0 OUTLIER 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.93 0.769 . . . . 0.0 111.455 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -118.11 163.85 16.01 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.271 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 5.3 t -81.51 140.04 34.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.993 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.27 -38.65 93.92 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.334 -0.46 . . . . 0.0 113.283 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.8 t -59.96 -44.07 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 26.7 p -106.33 -20.38 13.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.931 0.396 . . . . 0.0 111.582 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 65.04 36.03 7.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.503 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.11 146.5 50.68 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.379 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.0 tpp180 -52.02 148.64 5.86 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.466 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.546 HD13 ' HB3' ' A' ' 78' ' ' PRO . 75.6 mt -73.43 101.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.244 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.446 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 3.7 ptm180 -71.4 166.94 34.3 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.753 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -55.39 -43.1 61.64 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.267 1.978 . . . . 0.0 113.172 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.446 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.7 mt-10 -87.06 2.7 48.84 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.431 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.408 ' HG2' HD23 ' A' ' 72' ' ' LEU . 3.7 tpm_? -64.68 -25.66 68.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.677 0.275 . . . . 0.0 111.333 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 47.8 68.92 3.04 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.809 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.546 ' HB3' HD13 ' A' ' 72' ' ' LEU . 38.9 Cg_endo -66.98 140.77 55.75 Favored 'Trans proline' 0 C--N 1.298 -2.122 0 C-N-CA 122.971 2.447 . . . . 0.0 111.791 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -135.22 145.55 47.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.583 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 tp -100.29 122.18 42.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.417 HD11 HD22 ' A' ' 92' ' ' LEU . 2.2 mp -81.31 166.31 39.15 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.82 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -61.93 -16.68 51.2 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 123.015 2.476 . . . . 0.0 112.139 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.7 p -88.49 -1.22 57.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.403 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.27 45.66 0.19 Allowed 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 123.758 0.661 . . . . 0.0 110.998 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -129.71 122.23 28.5 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.443 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -86.52 138.06 32.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.217 -179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.609 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -153.46 165.64 35.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.731 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -68.73 138.77 55.16 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -56.28 -42.5 77.58 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.025 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.07 92.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 87.1 m -65.81 -36.39 83.36 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.156 0.503 . . . . 0.0 110.349 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.609 HD21 ' HB3' ' A' ' 87' ' ' ALA . 92.0 mt -66.72 -29.66 69.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.173 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.32 -60.67 6.06 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.79 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.57 -16.5 55.02 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.188 1.925 . . . . 0.0 112.452 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.58 -24.59 65.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.655 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -116.5 88.38 23.85 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -78.42 122.16 5.49 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 C-N-CA 122.513 2.142 . . . . 0.0 112.756 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.12 96.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.952 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 50.4 28.99 3.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.546 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.37 -38.79 88.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.564 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -60.35 -40.22 89.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.756 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.9 t -148.66 130.09 14.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.4 m -64.22 -40.6 96.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.568 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 93.25 145.54 17.42 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -62.75 -44.61 95.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.85 0.357 . . . . 0.0 110.367 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.0 160.47 34.05 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.66 85.98 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -104.71 25.73 9.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 110.462 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.94 85.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.473 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.74 113.5 3.98 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -177.42 58.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.09 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 101.82 -15.96 56.47 Favored Glycine 0 CA--C 1.518 0.23 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 -179.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 81.3 p -107.07 -121.23 0.24 Allowed 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.289 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 26.5 m -60.5 141.72 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-O 121.137 0.494 . . . . 0.0 109.94 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 50.6 t -107.47 131.12 58.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.581 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 49.4 p-10 -79.29 84.54 5.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.072 0.939 . . . . 0.0 109.901 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.61 137.08 77.37 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.822 -179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -55.34 -18.69 19.57 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 CA-C-N 120.21 1.111 . . . . 0.0 113.182 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 46.7 t -95.58 -63.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.479 -0.489 . . . . 0.0 112.202 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 20.7 p -86.6 -28.76 23.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.678 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 49.55 26.14 1.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.975 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -165.31 119.82 1.27 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.592 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -123.33 171.19 9.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.621 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 96.1 m -94.78 -51.94 4.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.478 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -145.02 174.98 10.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.606 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.516 ' HB2' HD13 ' A' ' 129' ' ' ILE . 64.8 p -108.43 50.12 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.054 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -88.05 -38.75 15.19 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.567 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.13 19.09 20.88 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.871 0.367 . . . . 0.0 111.774 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.516 HD13 ' HB2' ' A' ' 126' ' ' SER . 8.6 pt -61.41 -170.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.731 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.3 m -38.89 105.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.437 0 O-C-N 123.817 0.698 . . . . 0.0 110.547 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 174.91 -34.21 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.583 0 O-C-N 124.286 0.991 . . . . 0.0 110.812 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -84.51 72.53 10.63 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.815 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -68.76 138.14 54.61 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.936 0.398 . . . . 0.0 111.161 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -107.46 -177.09 3.25 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.39 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 98.2 mtp -62.0 149.53 40.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.233 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -79.37 59.3 2.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.201 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -62.05 117.43 5.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.321 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.47 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 85.1 p -165.51 173.0 11.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.693 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -57.99 -34.87 73.72 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 71.9 m -60.33 -39.02 85.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.978 0.418 . . . . 0.0 110.509 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -81.6 139.71 34.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.53 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -158.47 164.2 36.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.8 88.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 57.51 32.91 22.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.54 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 57.3 t0 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.458 -179.949 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -130.41 -96.09 0.74 Allowed Glycine 0 C--N 1.33 0.196 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.02 143.7 44.9 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.734 ' OE1' ' HB2' ' A' ' 142' ' ' ALA . 98.0 mt-10 -89.54 24.89 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.566 0.698 . . . . 0.0 111.064 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.673 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.69 -12.05 14.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.65 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.404 HD23 ' HG3' ' A' ' 63' ' ' GLU . 39.6 mt -48.65 -23.3 0.98 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.171 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.55 -43.08 93.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.01 0.433 . . . . 0.0 110.641 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.8 mt -104.39 -40.61 6.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.647 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.36 -86.71 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.673 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 166.55 -81.02 0.0 OUTLIER 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.79 0.681 . . . . 0.0 110.96 179.088 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.5 p-80 -113.35 163.21 15.14 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.34 0.591 . . . . 0.0 110.416 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 12.8 t -76.11 134.47 39.98 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.159 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.77 -36.92 92.88 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 116.407 -0.36 . . . . 0.0 112.9 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.5 t -60.04 -42.59 90.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 22.2 p -110.83 -18.16 13.17 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 63.72 37.84 9.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.391 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -125.31 145.89 49.81 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.773 179.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -52.67 147.44 8.63 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.26 109.79 8.03 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.874 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -77.71 157.51 79.46 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.112 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.34 -33.76 94.09 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.603 1.535 . . . . 0.0 111.249 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -90.4 -2.08 57.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.375 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -23.91 65.96 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 111.655 -178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.41 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 85.9 tt0 56.12 66.95 3.12 Favored Pre-proline 0 N--CA 1.446 -0.639 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.857 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.41 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.0 Cg_exo -61.99 146.93 96.06 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.995 2.463 . . . . 0.0 111.995 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -140.44 148.15 40.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.417 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 tp -102.69 130.0 49.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.173 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -89.28 166.58 20.89 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 121.081 0.467 . . . . 0.0 111.21 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.43 -20.72 69.59 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 123.268 2.645 . . . . 0.0 112.691 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 8.6 p -87.42 0.78 55.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.047 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 74.67 47.48 0.12 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.892 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.481 ' CE1' HG11 ' A' ' 119' ' ' VAL . 45.6 m170 -129.6 123.98 32.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.151 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.0 m -86.64 131.47 34.14 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.257 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.646 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -144.11 162.52 36.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.485 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.09 149.12 48.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.344 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 t -60.04 -46.52 89.24 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.396 0.617 . . . . 0.0 110.199 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.64 -39.99 95.58 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.785 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.6 m -70.08 -25.8 63.69 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.959 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.646 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.2 OUTLIER -69.89 -34.36 73.44 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.542 179.623 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -52.99 -58.68 10.94 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.815 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.77 -18.63 21.91 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 123.008 2.472 . . . . 0.0 112.582 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.05 -36.68 75.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.788 0.327 . . . . 0.0 110.344 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.84 120.25 79.79 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.053 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.01 154.79 52.93 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.93 1.753 . . . . 0.0 112.804 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.441 ' O ' ' HB3' ' A' ' 99' ' ' ALA . . . -90.29 44.77 1.22 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.116 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 98' ' ' ALA . . . 67.3 8.31 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.999 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.84 -40.53 97.72 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-O 120.84 0.353 . . . . 0.0 110.658 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -92.71 107.59 19.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.784 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 61.9 m -88.36 65.18 7.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 90.6 p -156.97 163.99 38.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.587 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 135.24 139.34 4.02 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -66.29 -41.65 89.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.816 0.341 . . . . 0.0 111.051 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -61.07 -40.64 98.8 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -152.83 160.1 28.84 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.71 -38.88 82.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.972 0.415 . . . . 0.0 110.359 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -127.92 157.96 39.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.394 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -80.35 -158.06 16.61 Favored Glycine 0 CA--C 1.519 0.293 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.4 t0 74.08 81.37 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.889 0.376 . . . . 0.0 110.572 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.0 -18.13 37.15 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 67.6 p -115.57 -118.85 0.32 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.423 ' O ' HG23 ' A' ' 114' ' ' VAL . 21.3 m -60.68 132.95 26.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.164 0.507 . . . . 0.0 110.312 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.53 131.27 56.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.066 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -71.14 135.56 47.69 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.591 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.466 ' O ' ' N ' ' A' ' 121' ' ' LYS . 24.3 t -115.75 132.86 22.95 Favored Pre-proline 0 C--N 1.315 -0.9 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.814 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -54.33 -17.83 13.04 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 CA-C-N 120.794 1.319 . . . . 0.0 112.493 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.481 HG11 ' CE1' ' A' ' 85' ' ' HIS . 2.7 t -94.38 -50.54 11.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.48 -31.31 11.35 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.452 0.644 . . . . 0.0 110.265 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.3 mptt 57.65 26.98 13.59 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.831 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -169.64 110.44 0.44 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.779 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -103.25 160.51 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.683 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 74.7 m -93.46 -44.42 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -145.3 167.78 22.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.534 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.564 ' HB2' HD13 ' A' ' 129' ' ' ILE . 51.3 p -105.16 44.45 1.03 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -179.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -88.42 -36.34 16.57 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -108.29 21.25 17.59 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.564 HD13 ' HB2' ' A' ' 126' ' ' SER . 13.3 pt -70.33 -170.02 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.424 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.501 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.7 OUTLIER -38.73 108.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 O-C-N 123.782 0.676 . . . . 0.0 110.39 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.1 -27.33 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 124.613 1.196 . . . . 0.0 110.772 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -84.41 74.46 10.36 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.753 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -85.67 114.02 22.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.031 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -96.79 -179.68 4.66 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.307 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 17.0 ptm -49.33 159.9 0.28 Allowed 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -98.36 80.24 2.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.446 -179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -80.7 106.61 12.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.553 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.1 p -170.34 156.59 5.73 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.42 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 56.85 34.44 65.21 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 49.7 m 57.44 40.7 27.09 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.149 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -105.6 140.73 38.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.734 ' HB2' ' OE1' ' A' ' 57' ' ' GLU . . . -150.21 141.53 23.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.571 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.51 98.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.46 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 69.4 p -135.17 162.54 32.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.584 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t0 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.523 179.868 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.642 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -160.76 -98.24 0.13 Allowed Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.506 ' HB3' ' HE ' ' A' ' 71' ' ' ARG . . . -60.18 138.34 57.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 110.317 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -92.03 21.87 4.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.461 0.648 . . . . 0.0 110.847 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.606 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.04 -12.42 11.69 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.815 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.455 HD23 ' HG3' ' A' ' 63' ' ' GLU . 35.5 mt -49.58 -23.64 1.76 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.347 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.39 -43.27 92.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 68.5 mt -104.19 -40.62 6.07 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.936 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.8 -87.87 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.606 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.0 OUTLIER 165.79 -79.28 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 O-C-N 124.06 0.85 . . . . 0.0 110.969 178.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -108.26 164.43 12.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.166 0.508 . . . . 0.0 110.513 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.518 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 10.6 t -76.17 135.03 39.76 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.931 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.41 -37.8 94.2 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 121.442 -0.409 . . . . 0.0 113.011 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.8 t -62.02 -42.71 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.53 -16.05 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.03 0.443 . . . . 0.0 110.962 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.12 29.22 16.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.415 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -114.89 143.83 44.51 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.496 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.506 ' HE ' ' HB3' ' A' ' 56' ' ' ALA . 33.2 ttt180 -54.4 151.35 7.71 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.769 -178.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.54 104.2 8.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.192 -178.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -77.34 157.22 80.82 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.363 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -56.16 -38.65 94.58 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 C-N-CA 121.787 1.658 . . . . 0.0 111.064 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -86.86 -1.88 58.15 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.898 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -67.86 -24.24 65.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.982 0.42 . . . . 0.0 111.134 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.431 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 78.5 tt0 57.65 65.71 3.3 Favored Pre-proline 0 N--CA 1.445 -0.705 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.296 -178.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.5 Cg_exo -63.05 146.45 94.59 Favored 'Trans proline' 0 C--N 1.301 -1.931 0 C-N-CA 122.367 2.044 . . . . 0.0 111.221 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -140.15 148.79 42.15 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.294 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.6 tp -103.38 127.53 50.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.142 0.496 . . . . 0.0 111.445 -178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 92' ' ' LEU . 4.4 mp -89.77 164.62 28.2 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.234 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.41 -6.73 19.8 Favored 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 123.037 2.491 . . . . 0.0 112.532 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 20.0 p -94.11 -0.87 55.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.404 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 77.46 41.52 0.14 Allowed 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 123.926 0.766 . . . . 0.0 110.969 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.479 ' NE2' HG11 ' A' ' 119' ' ' VAL . 33.4 m170 -134.58 119.2 18.11 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.679 178.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.5 m -87.02 140.26 29.74 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.712 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -152.41 164.1 38.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.578 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.0 m -65.34 137.59 57.62 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -56.32 -43.43 78.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.516 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.74 91.12 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 84.2 m -67.48 -33.55 75.34 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.53 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.712 HD21 ' HB3' ' A' ' 87' ' ' ALA . 74.7 mt -65.53 -37.33 86.45 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.04 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -47.57 -63.71 3.28 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.78 -27.03 69.47 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.882 2.388 . . . . 0.0 111.787 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.02 -39.67 86.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.559 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.43 122.94 85.71 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.054 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.05 143.99 81.24 Favored 'Trans proline' 0 N--CA 1.501 1.94 0 C-N-CA 122.09 1.86 . . . . 0.0 112.385 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -131.54 64.88 1.58 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.591 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.96 138.94 58.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.445 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.27 98.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.766 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -122.36 130.0 52.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.629 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -44.37 97.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.707 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.4 m 53.0 39.17 28.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.477 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 80.52 -172.65 54.6 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -60.98 -45.83 93.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.775 0.321 . . . . 0.0 110.475 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -86.38 179.39 49.33 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.11 2.66 90.58 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 120.979 -0.629 . . . . 0.0 111.671 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -140.04 144.3 36.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.837 0.351 . . . . 0.0 110.481 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.54 -40.1 93.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.523 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -173.52 -103.62 0.17 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.9 t0 70.23 76.2 0.2 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.924 0.392 . . . . 0.0 110.972 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.64 -13.16 46.77 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.4 p -115.99 -120.64 0.3 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.549 -0.325 . . . . 0.0 110.451 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.0 m -64.24 151.66 9.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.058 0.456 . . . . 0.0 110.673 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.89 133.89 65.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.819 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.23 113.71 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.151 0.501 . . . . 0.0 110.025 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -106.96 138.31 19.77 Favored Pre-proline 0 C--O 1.213 -0.828 0 CA-C-N 115.228 -0.897 . . . . 0.0 108.832 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.66 -15.41 48.58 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 121.165 1.243 . . . . 0.0 112.58 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.479 HG11 ' NE2' ' A' ' 85' ' ' HIS . 52.1 t -94.46 -61.99 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.576 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -90.45 -24.85 20.6 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.433 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.7 mptt 49.75 24.25 1.2 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.839 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -167.13 116.37 0.84 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.807 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -118.38 156.97 28.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.615 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 6.4 t -83.46 -49.95 8.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.15 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -141.19 176.8 8.55 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.489 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.03 50.79 1.11 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.56 0.695 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -85.03 -26.84 26.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.462 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -113.62 23.72 12.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 111.43 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 15.3 pt -60.16 -172.34 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.784 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.406 HG12 ' CD1' ' A' ' 92' ' ' LEU . 2.5 m -41.24 104.58 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 O-C-N 123.758 0.662 . . . . 0.0 110.698 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.38 -33.52 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.405 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -82.96 68.57 9.5 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.573 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -95.67 32.73 1.77 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -61.71 -39.04 90.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.55 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 4.7 mmt -95.14 127.61 41.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.104 0.478 . . . . 0.0 110.9 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -136.51 45.4 2.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.754 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -62.8 145.2 55.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.7 p -179.87 -40.64 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.833 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 92.46 150.77 26.65 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m 51.53 28.14 4.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 110.504 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -61.47 -44.51 96.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.1 143.79 57.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.535 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.73 150.73 34.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.563 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 81.8 p -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.566 -179.959 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.657 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -62.26 -39.67 98.01 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.558 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . -56.65 139.7 49.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.339 . . . . 0.0 110.116 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -89.27 12.39 16.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -58.97 -11.29 3.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.11 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.478 HD23 ' HG3' ' A' ' 63' ' ' GLU . 55.1 mt -47.39 -28.15 1.96 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.515 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -49.26 -45.98 45.61 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.67 -40.84 5.86 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.599 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.1 -83.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 123.432 0.457 . . . . 0.0 109.777 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.617 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.9 OUTLIER 164.65 -76.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.091 0.869 . . . . 0.0 111.303 179.383 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 -103.06 165.2 11.16 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.386 0.612 . . . . 0.0 110.41 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 20.2 t -81.35 135.94 35.71 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.205 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.09 92.67 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-N 116.521 -0.308 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.37 -41.16 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 4.4 p -113.56 -16.16 12.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.923 0.392 . . . . 0.0 111.16 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 62.99 38.83 10.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.319 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -128.1 145.28 51.05 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.098 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -51.69 153.78 2.25 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.336 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 78' ' ' PRO . 85.5 mt -82.56 102.42 11.39 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.863 -178.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -66.56 162.17 52.73 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.151 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.43 ' HG3' ' HB2' ' A' ' 142' ' ' ALA . 31.6 Cg_exo -58.31 -39.24 86.06 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 121.924 1.75 . . . . 0.0 111.05 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -90.17 0.81 56.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.512 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -66.88 -23.74 66.04 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.126 0.489 . . . . 0.0 110.784 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 50.61 74.51 0.79 Allowed Pre-proline 0 N--CA 1.45 -0.429 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.583 ' HB3' HD13 ' A' ' 72' ' ' LEU . 65.7 Cg_endo -70.71 152.81 64.67 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 123.03 2.487 . . . . 0.0 112.283 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -147.14 152.43 38.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.656 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 tp -108.92 128.41 54.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.313 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 mp -83.84 165.58 38.66 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.295 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -62.4 -16.7 53.37 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 123.126 2.551 . . . . 0.0 112.251 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.5 p -88.42 -0.9 57.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.4 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.34 49.17 0.07 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.432 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -133.99 124.02 25.59 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.267 -0.878 . . . . 0.0 109.605 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.4 m -86.52 140.28 30.06 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.307 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.584 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -156.08 163.83 39.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.916 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.3 m -65.14 149.87 49.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.211 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.3 t -59.99 -46.35 89.74 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.645 0.736 . . . . 0.0 109.796 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.23 96.85 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.271 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 99.4 m -69.88 -26.79 64.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 109.729 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.584 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -66.9 -38.25 85.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.696 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.9 -60.17 7.31 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.81 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.21 -29.29 37.15 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 123.283 2.655 . . . . 0.0 112.372 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.84 -38.4 81.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.186 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.56 116.49 66.41 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.04 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -58.39 146.01 91.69 Favored 'Trans proline' 0 N--CA 1.501 1.914 0 C-N-CA 122.114 1.876 . . . . 0.0 112.421 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -142.67 -87.74 0.14 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.74 -41.38 99.16 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.841 0.353 . . . . 0.0 110.782 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.12 94.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.882 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -90.22 99.69 12.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.74 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.2 m -109.24 -52.27 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.483 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 98.7 p -112.53 -18.3 12.44 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.999 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 86.13 173.09 49.14 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -165.84 164.07 18.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.848 0.356 . . . . 0.0 110.82 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 72.28 18.22 77.99 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 74.12 18.08 79.66 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -149.3 153.57 37.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.827 0.346 . . . . 0.0 110.519 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -142.29 145.54 34.11 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.471 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -106.35 -152.12 19.42 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 110.112 -1.195 . . . . 0.0 110.112 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t0 71.95 79.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.892 0.377 . . . . 0.0 111.006 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.58 -16.43 40.77 Favored Glycine 0 N--CA 1.453 -0.213 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.5 p -114.91 -120.55 0.3 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.647 -0.276 . . . . 0.0 110.356 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.413 ' H ' HG13 ' A' ' 114' ' ' VAL . 2.7 m -66.96 138.33 23.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.415 -179.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 59.1 t -110.47 132.09 59.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.8 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.25 122.52 25.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.731 0.777 . . . . 0.0 109.944 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 49.7 t -108.94 135.52 20.13 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.655 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.41 -11.19 15.64 Favored 'Trans proline' 0 C--N 1.302 -1.897 0 C-N-CA 121.084 1.19 . . . . 0.0 112.679 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -93.97 -62.41 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.648 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 10.2 p -96.8 -24.73 15.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.936 0.398 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 54.73 29.54 11.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.808 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -156.48 139.03 14.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.118 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -141.64 158.42 43.85 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.714 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 34.6 t -94.66 -55.04 3.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.169 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -144.0 175.18 10.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.564 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.531 ' HA ' HG23 ' A' ' 129' ' ' ILE . 78.9 p -104.46 54.24 0.73 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.674 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -87.62 -43.03 12.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.528 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -107.8 19.23 20.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.667 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.531 HG23 ' HA ' ' A' ' 126' ' ' SER . 3.7 pt -59.02 -172.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.624 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.477 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -39.33 112.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 O-C-N 123.827 0.704 . . . . 0.0 110.608 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 165.74 -29.62 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 124.621 1.201 . . . . 0.0 110.713 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -87.64 101.14 13.36 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.742 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 48.2 p90 -108.37 143.63 37.02 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.608 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -108.66 -81.01 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 16.8 tpt -145.09 141.24 28.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -89.27 44.55 1.22 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.742 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -81.82 146.41 29.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.686 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 52.7 p -142.52 -28.13 0.6 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.041 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 133.81 -169.34 22.89 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 99.0 p -68.06 -10.09 51.11 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.399 -0.4 . . . . 0.0 110.545 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -60.41 -29.98 69.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.176 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.43 ' HB2' ' HG3' ' A' ' 74' ' ' PRO . . . -61.2 138.4 58.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.496 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -155.27 152.39 29.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 70.8 p -70.04 -26.21 63.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.446 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 67.4 t0 . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.352 179.935 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.694 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.54 145.19 40.06 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 71' ' ' ARG . . . 61.92 113.86 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.12 0.486 . . . . 0.0 110.471 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -88.93 30.72 0.91 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.442 0.639 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.634 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.92 -12.5 18.38 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.529 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.438 HD23 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mt -49.23 -23.63 1.43 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.242 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -59.24 -43.21 92.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.989 0.423 . . . . 0.0 110.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.0 mt -104.3 -40.64 6.04 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.94 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.27 -87.97 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.634 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.9 OUTLIER 165.12 -79.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 O-C-N 123.987 0.804 . . . . 0.0 110.978 178.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -106.2 166.4 10.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.239 0.542 . . . . 0.0 110.688 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.6 t -79.2 135.34 36.77 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.259 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.28 -37.91 93.28 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.615 -0.326 . . . . 0.0 112.851 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.32 -41.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 30.0 p -110.04 -18.07 13.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.95 0.405 . . . . 0.0 111.204 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.34 39.67 9.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.53 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -128.76 144.1 51.08 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.123 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.562 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 7.8 ttm180 -50.7 152.6 1.97 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.366 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -81.14 112.47 18.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.977 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -82.78 158.38 65.35 Favored Pre-proline 0 N--CA 1.462 0.162 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.394 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.12 -40.24 86.15 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.063 1.842 . . . . 0.0 111.831 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -85.97 -0.32 55.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.43 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -67.51 -24.99 65.63 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 111.482 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.435 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 81.9 tt0 56.27 65.72 3.97 Favored Pre-proline 0 N--CA 1.444 -0.766 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.841 -177.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.435 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 23.4 Cg_exo -63.08 147.34 94.43 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.736 2.291 . . . . 0.0 111.545 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.432 ' HD3' HG23 ' A' ' 130' ' ' VAL . 0.7 OUTLIER -143.69 149.54 37.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.241 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.99 123.56 48.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.119 0.485 . . . . 0.0 112.154 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.586 HD11 HD22 ' A' ' 92' ' ' LEU . 2.7 mp -77.37 165.73 49.52 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.626 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -64.84 -16.17 54.03 Favored 'Trans proline' 0 C--N 1.307 -1.61 0 C-N-CA 123.245 2.63 . . . . 0.0 112.16 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 9.9 p -91.12 1.4 57.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.101 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 75.76 49.81 0.07 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.566 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.44 ' CD2' HG11 ' A' ' 119' ' ' VAL . 32.7 m170 -134.14 125.43 27.92 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.752 178.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.8 m -85.58 142.46 29.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.084 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.691 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -156.52 163.06 39.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.673 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.6 m -69.61 135.36 49.87 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.433 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.2 t -56.23 -39.8 73.09 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.634 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.97 88.38 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 76.7 m -67.24 -36.84 82.49 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.624 0.725 . . . . 0.0 110.215 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.691 HD21 ' HB3' ' A' ' 87' ' ' ALA . 73.3 mt -64.29 -35.96 82.54 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.776 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.47 -62.92 4.06 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.726 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.97 -21.4 27.89 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.512 2.142 . . . . 0.0 112.03 179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.443 ' O ' HG13 ' A' ' 115' ' ' VAL . . . -68.57 75.96 0.28 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -160.48 147.79 12.41 Favored Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -54.74 -40.45 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 122.175 1.916 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 45.32 30.72 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.116 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -120.76 104.75 10.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.832 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.46 99.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.491 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -73.25 133.06 43.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.73 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.4 m -62.35 145.62 53.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.367 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.5 t -147.85 147.45 29.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.717 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.35 158.42 29.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -63.55 143.69 57.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.762 0.315 . . . . 0.0 110.622 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 70.99 -155.14 52.65 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -70.78 157.91 53.61 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.859 -0.897 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.29 150.2 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.764 0.316 . . . . 0.0 110.489 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 114' ' ' VAL . . . -152.99 152.36 31.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.677 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 175.91 179.56 46.48 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.9 t0 63.45 70.19 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.945 0.402 . . . . 0.0 110.8 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.03 -8.51 38.89 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.6 p -116.16 -120.09 0.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.383 -0.229 . . . . 0.0 110.383 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.405 ' H ' HG13 ' A' ' 114' ' ' VAL . 2.4 m -62.72 145.11 13.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.074 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 95' ' ' ALA . 90.6 t -112.09 133.29 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.21 0.528 . . . . 0.0 111.63 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -74.22 106.42 5.86 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.829 0.824 . . . . 0.0 110.057 179.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 121' ' ' LYS . 7.6 t -104.05 126.99 30.21 Favored Pre-proline 0 C--O 1.202 -1.406 0 CA-C-N 114.756 -1.111 . . . . 0.0 108.63 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.32 -9.08 22.54 Favored 'Trans proline' 0 C--N 1.296 -2.226 0 CA-C-N 121.188 1.46 . . . . 0.0 113.171 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.44 HG11 ' CD2' ' A' ' 85' ' ' HIS . 40.5 t -85.82 -54.88 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.147 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.4 p -105.49 -27.79 11.2 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.118 0.485 . . . . 0.0 110.482 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 0.3 OUTLIER 62.05 35.9 15.7 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.209 178.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -166.74 141.84 4.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -150.22 158.75 44.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.638 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 79.2 m -96.04 -47.38 6.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.438 . . . . 0.0 110.089 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -142.61 176.45 9.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.355 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.55 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.6 OUTLIER -120.87 46.74 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.44 0.638 . . . . 0.0 111.374 179.601 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.23 -30.45 19.69 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.349 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -106.19 16.74 24.5 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.55 HD13 ' HB2' ' A' ' 126' ' ' SER . 44.5 pt -70.95 -169.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.99 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.432 HG23 ' HD3' ' A' ' 79' ' ' ARG . 0.2 OUTLIER -41.67 109.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 O-C-N 123.727 0.642 . . . . 0.0 110.075 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 163.92 -34.25 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 124.827 1.33 . . . . 0.0 111.072 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -59.59 -42.23 92.08 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 75.9 t80 37.9 73.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.965 0.79 . . . . 0.0 111.193 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.76 -50.3 74.36 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.99 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.3 ttt 178.03 -165.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 110.385 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.7 mtm180 -116.6 92.81 3.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.807 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.93 -36.62 79.81 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -43.36 130.02 4.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.922 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -84.55 57.93 5.01 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 57.1 m 52.05 37.9 22.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.769 0.319 . . . . 0.0 110.679 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -72.0 132.18 43.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.778 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -150.23 150.24 31.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.592 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -154.08 150.58 28.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.718 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 71.0 p -89.44 -14.34 35.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.974 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.0 t0 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.221 -179.937 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.582 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 83.06 0.99 90.59 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . 60.79 109.12 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.001 0.429 . . . . 0.0 110.449 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -86.74 26.59 1.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.49 0.662 . . . . 0.0 110.709 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.15 -12.1 11.33 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.584 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.438 HD23 ' HG3' ' A' ' 63' ' ' GLU . 46.3 mt -47.48 -23.8 0.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.989 179.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -59.66 -43.09 94.07 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.643 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.0 mt -103.96 -40.95 6.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.366 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.46 -88.28 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.683 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.4 mt-10 164.6 -81.17 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.85 0.718 . . . . 0.0 110.891 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -102.22 168.91 9.05 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.095 0.474 . . . . 0.0 110.134 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.423 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 12.4 t -84.34 138.43 32.89 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.032 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.28 -36.41 89.55 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 121.584 -0.341 . . . . 0.0 113.075 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 79.7 t -59.61 -43.16 90.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.7 p -109.0 -20.53 13.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.968 0.414 . . . . 0.0 111.305 -178.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 65.62 34.26 7.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.421 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -126.42 145.69 50.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.119 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 9.6 ttm-85 -49.71 149.75 2.37 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.531 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.18 115.58 14.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.772 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -80.75 162.08 61.53 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.507 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.27 -38.08 46.41 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 121.791 1.66 . . . . 0.0 111.585 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -90.65 0.61 57.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.821 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -24.28 66.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.91 0.386 . . . . 0.0 111.522 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 55.92 69.0 2.04 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-O 121.289 0.566 . . . . 0.0 110.206 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.54 151.68 70.36 Favored 'Trans proline' 0 C--N 1.299 -2.027 0 C-N-CA 123.442 2.762 . . . . 0.0 111.963 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -144.87 167.01 23.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.821 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.38 126.26 51.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.569 HD11 HD22 ' A' ' 92' ' ' LEU . 3.9 mp -86.63 164.68 36.39 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.278 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.46 -6.0 18.06 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.926 2.417 . . . . 0.0 112.063 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -94.33 2.34 55.83 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.333 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 76.42 39.15 0.27 Allowed 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.513 0.673 . . . . 0.0 111.222 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.494 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.1 m170 -134.5 120.29 19.52 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.944 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.9 m -86.56 142.83 28.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.779 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -154.13 167.41 29.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.882 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.437 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.2 m -71.32 136.13 47.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.6 t -53.04 -42.96 66.25 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.92 91.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 92.2 m -68.44 -33.58 74.45 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.659 0.742 . . . . 0.0 110.495 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.779 HD21 ' HB3' ' A' ' 87' ' ' ALA . 70.4 mt -63.97 -36.37 83.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.162 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.77 -65.27 2.94 Favored Glycine 0 CA--C 1.529 0.925 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.97 -29.73 74.8 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.016 2.477 . . . . 0.0 111.551 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.69 -38.17 77.67 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.463 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.68 123.24 71.11 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.461 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -53.82 143.6 58.68 Favored 'Trans proline' 0 N--CA 1.498 1.758 0 C-N-CA 122.006 1.804 . . . . 0.0 112.192 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 99' ' ' ALA . . . -109.01 41.51 1.6 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.44 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 98' ' ' ALA . . . 64.99 11.49 7.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.87 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.44 -39.7 94.19 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 120.929 0.395 . . . . 0.0 110.632 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -156.58 -178.93 7.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.696 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.3 t -111.41 136.06 51.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.532 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.6 m -60.97 -41.03 95.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.549 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 178.2 172.24 42.41 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -67.08 139.67 57.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.683 0.278 . . . . 0.0 110.423 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 71.66 -170.4 48.83 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 56.48 -131.51 51.05 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -124.82 124.46 42.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.857 0.36 . . . . 0.0 110.594 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.37 92.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.419 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 122.8 -176.91 16.59 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.7 t0 67.89 83.84 0.16 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 110.924 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.42 -18.26 35.81 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.7 p -115.22 -120.71 0.3 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.656 -0.272 . . . . 0.0 110.318 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.431 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.0 m -63.17 142.94 16.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.936 0.398 . . . . 0.0 110.203 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 96.7 t -113.48 139.95 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.253 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.4 116.17 21.75 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.395 0.617 . . . . 0.0 109.894 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 48.9 t -106.04 133.99 19.96 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.196 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.73 -11.35 11.54 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.272 1.315 . . . . 0.0 113.302 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.494 HG11 ' NE2' ' A' ' 85' ' ' HIS . 15.0 t -94.59 -62.14 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.475 -178.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.7 p -97.14 -26.55 14.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.017 0.436 . . . . 0.0 110.568 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.6 mptt 56.25 27.51 11.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.707 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -160.37 136.24 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.947 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -141.6 161.81 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.67 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . 0.564 ' HG ' ' HD1' ' A' ' 125' ' ' PHE . 11.7 p -95.28 -43.81 7.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.363 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.564 ' HD1' ' HG ' ' A' ' 124' ' ' CYS . 50.8 m-85 -143.26 177.08 8.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.896 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.445 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.2 OUTLIER -119.99 53.53 1.07 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 111.58 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -88.65 -30.34 19.25 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.699 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -112.62 23.06 13.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.615 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.445 HD13 ' HB2' ' A' ' 126' ' ' SER . 18.0 pt -70.15 -172.95 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 120.882 0.372 . . . . 0.0 111.35 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.4 OUTLIER -45.25 106.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.84 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.574 179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 163.87 -40.1 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 124.973 1.421 . . . . 0.0 111.106 -179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -89.99 72.88 7.41 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.691 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 p90 -68.14 143.56 55.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.108 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.22 -78.38 0.57 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.395 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.0 mmm -129.42 147.11 51.21 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.616 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 95.6 mtm-85 -110.31 42.17 1.61 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.454 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -73.15 153.14 40.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.641 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.611 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 79.2 p -175.99 -69.06 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.878 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -157.11 -109.25 0.29 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 6.2 t -85.37 61.77 7.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 0.0 110.43 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -58.51 -38.4 77.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.695 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.46 -36.44 75.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.72 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -66.08 145.59 55.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.577 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 74.2 p -68.25 -29.14 67.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.527 179.877 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.724 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.69 158.21 53.43 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 58.63 94.31 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.884 0.373 . . . . 0.0 110.694 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -86.38 42.54 1.0 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.653 0.739 . . . . 0.0 110.73 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.715 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.85 -13.3 23.09 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.999 -1.0 . . . . 0.0 111.366 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.441 HD23 ' HG3' ' A' ' 63' ' ' GLU . 32.3 mt -47.31 -24.58 0.79 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.411 0.444 . . . . 0.0 110.969 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -60.28 -44.35 95.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.989 0.423 . . . . 0.0 110.806 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 80' ' ' LEU . 83.1 mt -103.58 -42.63 5.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.658 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.07 -90.63 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.715 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.4 OUTLIER 166.22 -80.13 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.703 0.801 . . . . 0.0 111.298 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -107.59 165.42 11.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.359 0.6 . . . . 0.0 110.346 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.426 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 40.9 t -79.62 147.76 31.93 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.606 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -35.98 40.35 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.187 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 68.1 t -62.57 -37.6 79.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.932 0.396 . . . . 0.0 111.498 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -108.09 -26.19 10.76 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.383 -178.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 66.51 24.66 10.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.791 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -122.26 150.3 42.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.236 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -50.91 150.17 3.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.28 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.8 mt -80.59 118.41 22.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.347 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -95.28 165.72 16.25 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.022 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -52.56 -51.19 11.69 Favored 'Trans proline' 0 C--N 1.303 -1.862 0 C-N-CA 122.164 1.909 . . . . 0.0 112.96 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -72.14 -7.42 49.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.079 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.28 -24.34 64.86 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 121.106 -0.238 . . . . 0.0 110.919 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 49.03 71.64 1.53 Allowed Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 121.075 0.465 . . . . 0.0 110.086 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.58 148.13 82.96 Favored 'Trans proline' 0 C--N 1.295 -2.244 0 C-N-CA 122.819 2.346 . . . . 0.0 112.15 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.39 144.77 32.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.925 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 61' ' ' LEU . 0.6 OUTLIER -100.46 126.09 46.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.094 0.473 . . . . 0.0 111.104 -179.705 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 92' ' ' LEU . 4.6 mp -87.95 164.15 34.96 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.988 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -70.59 -6.77 19.78 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 C-N-CA 122.784 2.323 . . . . 0.0 112.025 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.8 p -94.56 2.52 55.66 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.509 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 74.45 41.59 0.35 Allowed 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 123.96 0.787 . . . . 0.0 111.074 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.432 ' NE2' HG11 ' A' ' 119' ' ' VAL . 33.6 m170 -134.62 118.15 16.89 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.031 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.46 135.55 33.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.242 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.701 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -149.89 167.46 26.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.512 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.3 m -71.6 135.49 46.99 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.955 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.4 t -51.63 -44.08 62.82 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.491 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.06 92.78 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.589 -0.445 . . . . 0.0 109.946 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 89.6 m -68.29 -33.53 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.698 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.701 HD21 ' HB3' ' A' ' 87' ' ' ALA . 88.7 mt -65.14 -35.43 81.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.486 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -44.29 -64.98 1.82 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -63.12 -20.74 71.85 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.633 2.222 . . . . 0.0 112.137 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.99 -38.29 85.49 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.032 0.444 . . . . 0.0 109.899 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.88 122.31 84.47 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.368 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.02 141.72 56.06 Favored 'Trans proline' 0 N--CA 1.502 1.987 0 C-N-CA 122.423 2.082 . . . . 0.0 112.41 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -143.07 -80.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 178.3 32.3 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.491 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.43 -41.29 96.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.663 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -126.32 -30.07 2.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.662 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 80.7 p -71.32 157.22 38.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.583 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.0 t -62.79 -43.78 97.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.625 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 138.84 -138.64 9.56 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 55.69 43.71 27.58 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.836 0.35 . . . . 0.0 110.628 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -78.68 179.73 52.13 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.32 -56.47 0.56 Allowed Glycine 0 CA--C 1.527 0.807 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.55 -40.25 94.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.353 . . . . 0.0 110.408 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -144.16 101.64 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.563 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 90.36 169.69 43.28 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.6 t0 64.5 77.23 0.32 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.737 0.303 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.55 -15.9 45.15 Favored Glycine 0 N--CA 1.452 -0.281 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 -179.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 80.9 p -115.58 -121.14 0.3 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.666 -0.267 . . . . 0.0 110.998 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.403 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.1 m -61.8 143.67 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 120.871 0.367 . . . . 0.0 110.052 -179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 69.5 t -110.99 137.32 43.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.479 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -81.72 113.44 19.7 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.608 0.718 . . . . 0.0 111.035 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 121' ' ' LYS . 42.7 t -104.11 133.78 20.05 Favored Pre-proline 0 C--N 1.312 -1.042 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.464 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.29 -10.45 8.51 Favored 'Trans proline' 0 C--N 1.301 -1.961 0 C-N-CA 121.682 1.588 . . . . 0.0 113.433 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 85' ' ' HIS . 38.9 t -94.81 -61.82 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.939 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 13.0 p -98.12 -29.5 13.2 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 110.95 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.0 mptt 58.01 28.99 17.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -161.42 137.29 7.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.717 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -143.85 154.38 43.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.732 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 5.6 t -83.76 -50.05 8.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -139.25 176.98 8.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.869 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.99 45.23 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.735 0.778 . . . . 0.0 111.599 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -86.53 -19.58 29.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.414 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.59 22.63 13.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.999 0.428 . . . . 0.0 110.908 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 25.2 pt -63.71 -170.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.5 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -40.69 103.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 O-C-N 123.895 0.747 . . . . 0.0 110.66 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 175.38 -31.74 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 124.186 0.929 . . . . 0.0 110.79 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -84.96 71.05 10.97 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.126 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -92.66 31.14 1.4 Allowed 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.938 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.38 -37.26 80.19 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.425 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 36.5 tpp -82.55 109.33 16.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.799 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 77.1 mtm180 -152.78 82.97 1.22 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.802 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -119.97 11.39 11.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.019 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 15.5 m -62.47 141.07 58.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.739 0.304 . . . . 0.0 110.241 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 177.52 -165.94 36.02 Favored Glycine 0 CA--C 1.522 0.49 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 51.2 m 57.91 26.0 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.647 0.261 . . . . 0.0 110.336 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -128.65 131.19 48.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.136 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.32 150.98 31.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.799 0.333 . . . . 0.0 110.707 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -152.87 155.08 36.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.607 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 80.8 p -74.5 162.67 28.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.537 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 . . . . . 0 C--O 1.219 -0.519 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.575 -179.89 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.658 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.69 149.68 46.92 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 52.28 95.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.105 0.478 . . . . 0.0 110.835 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -88.22 30.66 0.85 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.432 0.634 . . . . 0.0 110.669 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.633 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.12 -12.47 12.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.51 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.43 HD23 ' HG3' ' A' ' 63' ' ' GLU . 39.5 mt -48.5 -23.76 1.08 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.334 179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -59.05 -42.65 90.77 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.475 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.9 mt -104.17 -39.98 6.32 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.785 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.2 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.633 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.6 OUTLIER 164.94 -79.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 O-C-N 124.114 0.884 . . . . 0.0 111.045 178.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -108.03 166.92 10.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.263 0.554 . . . . 0.0 110.468 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.426 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 10.0 t -77.37 135.66 38.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.309 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.26 -38.22 94.87 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.492 -0.385 . . . . 0.0 112.779 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.432 HG22 ' HG3' ' A' ' 118' ' ' PRO . 72.4 t -61.41 -42.54 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 27.5 p -110.14 -16.33 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.925 0.393 . . . . 0.0 111.074 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.28 28.8 15.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.548 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -115.6 145.28 42.83 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.915 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -52.71 149.24 6.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.447 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.71 103.19 5.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.812 -178.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -71.38 157.72 89.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.385 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -37.14 95.65 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 121.616 1.544 . . . . 0.0 110.785 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.18 0.7 55.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.209 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -67.33 -24.76 65.77 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 111.332 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.439 ' N ' ' HD3' ' A' ' 78' ' ' PRO . 87.6 tt0 53.72 66.28 4.67 Favored Pre-proline 0 N--CA 1.438 -1.042 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.418 -177.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 77' ' ' GLU . 24.9 Cg_exo -62.0 146.2 96.38 Favored 'Trans proline' 0 C--N 1.302 -1.887 0 C-N-CA 122.458 2.105 . . . . 0.0 111.906 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.436 ' CB ' HD22 ' A' ' 92' ' ' LEU . 95.9 mtt180 -138.82 142.67 38.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.541 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.6 tp -99.82 126.55 45.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.307 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.522 HD23 ' OE1' ' A' ' 123' ' ' GLN . 1.9 mp -83.45 165.59 39.46 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.884 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -64.74 -14.42 44.7 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 123.205 2.604 . . . . 0.0 112.502 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.9 p -92.15 1.04 57.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.15 46.72 0.09 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.04 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -131.11 119.32 21.77 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.487 178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 m -87.1 132.53 33.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.995 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.616 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -147.25 162.37 39.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.4 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 8.7 m -59.52 147.56 36.41 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.27 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 t -60.42 -44.28 95.91 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.344 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.47 -40.63 97.28 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.901 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.9 m -67.64 -34.12 76.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.064 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.616 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -63.86 -36.99 85.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.155 -179.129 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -50.61 -59.99 7.34 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.327 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -64.0 -16.42 54.8 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.43 2.087 . . . . 0.0 112.139 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.34 -37.58 81.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.008 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.36 126.26 72.15 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.606 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.32 144.06 92.16 Favored 'Trans proline' 0 N--CA 1.501 1.961 0 C-N-CA 122.006 1.804 . . . . 0.0 112.414 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -147.98 139.15 23.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.718 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -159.14 140.07 12.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.582 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.08 -40.93 99.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.788 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -143.92 109.95 5.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 31.7 t -85.34 125.99 33.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.561 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 96.3 p -63.34 -26.8 68.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.474 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 62.48 -147.09 49.72 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 52.5 t0 51.57 44.2 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.726 0.298 . . . . 0.0 110.618 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 175.33 -179.24 46.69 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -121.23 -156.84 9.9 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.39 39.93 6.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.874 0.369 . . . . 0.0 110.737 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.45 148.29 29.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.604 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -115.06 -115.19 3.02 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.172 -1.171 . . . . 0.0 110.172 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.5 t0 75.47 81.34 0.1 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.051 0.453 . . . . 0.0 111.459 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 104.75 -17.34 45.97 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.26 -123.18 0.29 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.1 m -62.05 148.08 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-O 121.416 0.627 . . . . 0.0 110.715 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 88.3 t -107.57 141.52 22.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.205 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.34 135.08 34.04 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.027 -0.669 . . . . 0.0 109.971 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 42.0 t -122.82 134.25 24.92 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.369 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.432 ' HG3' HG22 ' A' ' 67' ' ' VAL . 34.5 Cg_endo -64.91 -9.16 20.26 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 CA-C-N 120.431 1.19 . . . . 0.0 112.556 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 17.3 t -93.26 -61.27 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.326 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 29.1 p -99.51 -22.28 15.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.4 mptt 55.07 29.25 12.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.157 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -162.03 129.92 4.05 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.988 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.522 ' OE1' HD23 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -122.72 130.59 53.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.895 179.49 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 93.4 m -61.69 -47.7 84.1 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.772 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -145.2 176.8 9.26 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.465 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.423 ' HA ' HG23 ' A' ' 129' ' ' ILE . 0.1 OUTLIER -109.3 32.18 5.17 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.017 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -86.2 -31.17 21.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.628 -179.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -103.86 22.49 14.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.884 0.373 . . . . 0.0 111.668 -179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.423 HG23 ' HA ' ' A' ' 126' ' ' SER . 41.3 pt -68.19 -169.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.775 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.424 HG13 HD23 ' A' ' 92' ' ' LEU . 2.2 m -36.49 104.93 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.34 0 O-C-N 124.045 0.84 . . . . 0.0 110.828 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 170.79 -32.75 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 124.027 0.829 . . . . 0.0 110.362 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -83.45 64.36 7.81 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.795 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -97.81 29.25 3.47 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.414 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.4 -48.01 83.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.628 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 6.7 tpt -77.31 119.83 21.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.23 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.8 mtm180 -123.8 35.82 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.035 0.445 . . . . 0.0 110.806 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.47 141.89 58.18 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.757 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 78.9 p -174.65 -30.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.132 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 178.14 -151.31 10.52 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 96.4 p -62.28 -20.39 64.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.01 0.434 . . . . 0.0 110.575 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.21 136.44 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.253 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 52.81 21.63 2.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.953 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -71.56 144.42 49.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.784 0.326 . . . . 0.0 110.796 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -74.51 -30.14 61.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.518 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 66.7 t0 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.42 -179.977 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.623 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 74.3 25.05 71.7 Favored Glycine 0 CA--C 1.52 0.402 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.435 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . 62.31 112.94 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.093 0.473 . . . . 0.0 110.387 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.705 ' OE1' ' HB2' ' A' ' 142' ' ' ALA . 49.7 mp0 -84.0 32.42 0.48 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.475 0.655 . . . . 0.0 110.823 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.664 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.87 -11.65 13.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.405 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.404 HD23 ' HG3' ' A' ' 63' ' ' GLU . 55.5 mt -48.36 -22.36 0.68 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.612 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -58.44 -42.37 87.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.068 0.461 . . . . 0.0 110.206 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.5 mt -104.31 -39.59 6.42 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.72 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.26 -84.1 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.664 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.1 mt-10 166.52 -80.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 O-C-N 123.978 0.799 . . . . 0.0 110.966 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.99 170.14 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.104 0.478 . . . . 0.0 110.157 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.461 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 23.8 t -87.59 141.87 28.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.335 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.29 -39.21 92.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.653 -0.308 . . . . 0.0 112.38 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 74.9 t -61.52 -37.91 78.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -177.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -24.67 10.89 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.177 0.513 . . . . 0.0 111.116 -178.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 65.43 33.0 9.17 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.836 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -128.81 149.08 50.89 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.78 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -52.6 147.94 7.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.904 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.456 HD13 ' HB3' ' A' ' 78' ' ' PRO . 73.6 mt -72.78 116.51 13.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.001 -178.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.95 161.8 72.32 Favored Pre-proline 0 N--CA 1.463 0.224 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.305 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.67 -40.26 74.95 Favored 'Trans proline' 0 C--N 1.309 -1.517 0 C-N-CA 122.083 1.856 . . . . 0.0 111.641 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -90.03 1.92 55.78 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.296 179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.29 -24.83 66.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.669 -178.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 52.48 70.56 1.82 Allowed Pre-proline 0 C--N 1.32 -0.674 0 CA-C-O 121.351 0.596 . . . . 0.0 109.899 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.456 ' HB3' HD13 ' A' ' 72' ' ' LEU . 57.4 Cg_endo -70.11 153.57 67.18 Favored 'Trans proline' 0 C--N 1.294 -2.32 0 C-N-CA 122.843 2.362 . . . . 0.0 111.412 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.412 ' HD2' HG12 ' A' ' 130' ' ' VAL . 0.0 OUTLIER -148.6 174.62 11.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.506 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -126.06 141.07 52.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.986 0.422 . . . . 0.0 111.33 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.534 ' CD1' HD22 ' A' ' 92' ' ' LEU . 2.2 mp -101.17 165.6 13.88 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-O 121.136 0.493 . . . . 0.0 110.897 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.51 -16.45 54.69 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 123.318 2.679 . . . . 0.0 112.155 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 26.7 p -86.31 -6.09 59.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.317 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 78.14 48.01 0.05 OUTLIER 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.923 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -129.98 121.74 27.13 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.295 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.4 m -87.06 138.64 31.32 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.998 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.695 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -157.92 166.69 31.98 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.127 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.468 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.7 m -68.83 139.68 55.22 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 t -56.75 -42.84 80.02 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.298 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.38 -40.41 94.22 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 97.8 m -71.01 -22.14 62.2 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.235 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.695 HD21 ' HB3' ' A' ' 87' ' ' ALA . 84.3 mt -81.17 -20.72 40.63 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.525 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -59.84 -53.42 46.07 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 120.556 -0.831 . . . . 0.0 111.571 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.24 -19.31 33.85 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.641 2.227 . . . . 0.0 111.779 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.99 -38.19 78.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -94.13 147.56 33.61 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.992 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.16 -20.69 55.85 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.559 2.172 . . . . 0.0 112.562 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.18 -38.81 80.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 146.22 47.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.428 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.43 88.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.709 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -82.83 82.18 8.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.923 0.392 . . . . 0.0 110.333 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.6 p -155.92 166.08 34.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.52 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 91.2 p -132.63 155.1 49.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.456 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -61.54 -40.98 99.45 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 53.0 t0 51.71 46.14 27.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 110.504 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 76.62 -164.38 53.22 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -97.84 117.43 5.81 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -156.69 153.12 27.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.737 0.303 . . . . 0.0 110.628 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.63 142.5 58.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.699 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 167.23 -175.42 42.36 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.9 t0 69.22 76.75 0.23 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.948 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.08 -17.68 37.54 Favored Glycine 0 N--CA 1.452 -0.236 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 82.2 p -115.11 -120.92 0.3 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.568 -0.316 . . . . 0.0 110.17 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.29 142.83 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 121.017 0.437 . . . . 0.0 110.311 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.3 t -107.17 129.84 60.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.717 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -74.29 123.76 25.17 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.964 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 121' ' ' LYS . 23.4 t -106.76 129.65 24.09 Favored Pre-proline 0 C--O 1.199 -1.57 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.874 -179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -61.36 -10.22 15.28 Favored 'Trans proline' 0 C--N 1.295 -2.273 0 CA-C-N 121.715 1.648 . . . . 0.0 113.34 -178.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.7 t -85.81 -43.73 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.394 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -120.21 -30.07 4.71 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.503 0.668 . . . . 0.0 110.307 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.9 OUTLIER 65.14 35.16 8.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.146 178.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -164.3 123.12 1.87 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.32 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.13 159.64 23.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.344 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.2 m -87.59 -55.85 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.58 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -143.52 176.82 8.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 16.0 p -101.82 27.2 6.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.022 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -88.52 -28.83 20.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.382 -179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -112.72 22.68 14.27 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.654 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.1 pt -86.04 -169.95 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.966 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.412 HG12 ' HD2' ' A' ' 79' ' ' ARG . 2.2 m -43.27 106.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 O-C-N 123.721 0.638 . . . . 0.0 110.248 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 167.64 -22.41 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 124.408 1.067 . . . . 0.0 110.864 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -97.56 22.62 8.69 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.983 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -41.2 139.29 1.0 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.416 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -161.52 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.088 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.08 144.02 50.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.947 0.403 . . . . 0.0 110.059 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -82.66 68.45 9.13 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.458 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.58 134.27 54.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.922 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 12.6 p 177.48 145.42 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.624 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 53.81 -129.41 41.73 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 95.9 p -93.69 -1.21 55.5 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.925 -0.637 . . . . 0.0 111.109 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -83.54 127.36 33.67 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.824 0.345 . . . . 0.0 110.65 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.705 ' HB2' ' OE1' ' A' ' 57' ' ' GLU . . . -155.43 139.95 16.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.292 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.31 96.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.57 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 65.6 p -78.68 163.98 24.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.522 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.2 t0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 118.11 -0.947 . . . . 0.0 110.573 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.98 -96.61 0.12 Allowed Glycine 0 CA--C 1.523 0.591 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.636 ' HB3' ' HE ' ' A' ' 71' ' ' ARG . . . -59.78 119.01 6.86 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -95.26 20.5 9.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.397 0.618 . . . . 0.0 110.576 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.0 -12.32 18.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.63 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.416 HD23 ' HG3' ' A' ' 63' ' ' GLU . 36.6 mt -49.01 -23.67 1.24 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.165 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -59.68 -43.5 93.99 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.691 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 80' ' ' LEU . 57.5 mt -104.47 -41.56 5.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.599 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.74 -89.93 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.631 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 165.24 -79.03 0.0 OUTLIER 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.5 0.72 . . . . 0.0 110.836 179.569 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 -99.87 167.22 10.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.117 0.484 . . . . 0.0 110.116 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 27.2 t -82.05 136.72 35.19 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.516 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -71.46 -30.07 67.26 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.72 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.1 t -61.53 -39.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.23 -17.39 11.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 0.0 111.22 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.75 38.43 9.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.791 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -129.3 144.9 51.4 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.043 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.636 ' HE ' ' HB3' ' A' ' 56' ' ' ALA . 42.4 ttt180 -50.71 148.89 3.64 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.426 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.4 HD13 ' HB3' ' A' ' 78' ' ' PRO . 80.0 mt -75.47 120.24 20.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.466 -178.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -82.76 163.03 53.4 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.204 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.08 -34.09 47.93 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 121.908 1.738 . . . . 0.0 111.579 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -92.68 -2.03 56.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.389 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -66.89 -23.88 66.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.233 0.54 . . . . 0.0 111.514 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 54.72 70.34 1.7 Allowed Pre-proline 0 N--CA 1.446 -0.636 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.877 -178.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.4 ' HB3' HD13 ' A' ' 72' ' ' LEU . 40.3 Cg_endo -67.49 149.26 80.04 Favored 'Trans proline' 0 C--N 1.3 -1.986 0 C-N-CA 123.148 2.565 . . . . 0.0 111.913 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -141.7 162.29 35.85 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.131 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 61' ' ' LEU . 57.6 tp -115.44 127.69 55.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.903 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.75 164.55 36.62 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.842 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 -6.42 19.04 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.92 2.413 . . . . 0.0 112.334 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.6 p -95.38 3.95 53.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 75.22 41.21 0.3 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.521 0.677 . . . . 0.0 111.346 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.495 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.3 m170 -134.55 119.75 18.82 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.732 178.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.9 m -86.64 139.63 30.61 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.911 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.648 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -149.95 166.86 28.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 -179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 3.9 m -68.2 151.84 46.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.697 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.4 t -60.35 -47.15 87.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.337 0.589 . . . . 0.0 110.22 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.34 -40.02 96.14 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.135 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.81 -27.1 64.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.998 0.427 . . . . 0.0 109.85 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.648 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -68.34 -37.87 80.94 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.824 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.12 -61.31 5.47 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.21 -29.51 76.02 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.961 2.441 . . . . 0.0 111.682 178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.45 -40.5 91.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.172 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -87.67 117.99 69.21 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.143 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.52 137.66 73.2 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 121.941 1.761 . . . . 0.0 112.21 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.93 -27.18 14.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.576 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -159.07 156.92 30.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -96.05 82.77 3.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.637 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -62.62 -42.22 99.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.5 m -71.13 148.68 47.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.4 t -133.77 128.2 34.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.446 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.92 4.37 89.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -102.81 149.56 24.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.328 . . . . 0.0 110.645 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.97 152.37 51.0 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.67 18.2 79.2 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.09 -38.89 87.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.751 0.31 . . . . 0.0 110.6 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -58.19 138.85 55.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.487 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 177.93 173.95 43.82 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.1 t0 68.24 82.53 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.534 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.93 -14.69 40.9 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.3 t -116.74 -121.44 0.3 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.341 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 123' ' ' GLN . 3.2 m -62.78 143.54 15.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 122.078 -0.389 . . . . 0.0 110.482 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 98.7 t -119.34 131.06 73.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.985 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.41 ' O ' ' HB1' ' A' ' 95' ' ' ALA . 0.4 OUTLIER -69.89 141.76 53.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.204 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.482 ' H ' ' HA ' ' A' ' 121' ' ' LYS . 19.2 t -139.94 132.77 15.04 Favored Pre-proline 0 N--CA 1.444 -0.733 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.484 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.406 ' HA ' ' HD2' ' A' ' 121' ' ' LYS . 31.1 Cg_endo -63.06 -9.59 17.58 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 121.384 1.389 . . . . 0.0 112.798 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.495 HG11 ' NE2' ' A' ' 85' ' ' HIS . 6.5 t -94.56 -61.04 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.4 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 11.0 p -99.05 -27.13 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.782 0.325 . . . . 0.0 110.983 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.482 ' HA ' ' H ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER 57.5 31.7 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.037 179.336 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -168.25 136.69 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.451 ' O ' HG12 ' A' ' 114' ' ' VAL . 2.6 mm-40 -142.3 123.53 14.68 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.52 179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 91.8 m -61.79 -44.33 97.09 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -144.12 177.18 8.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.635 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.459 ' HB2' HD13 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -121.0 63.75 0.87 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.273 0.558 . . . . 0.0 111.582 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -89.14 -30.0 18.93 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.507 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.2 23.14 13.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 111.535 -178.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.459 HD13 ' HB2' ' A' ' 126' ' ' SER . 10.6 pt -64.69 -169.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.35 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.643 HG13 HD23 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -35.59 104.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 O-C-N 123.924 0.765 . . . . 0.0 110.578 -179.674 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 172.54 -34.2 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 124.135 0.897 . . . . 0.0 110.599 -179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -83.99 70.18 10.42 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.808 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -97.39 33.0 2.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.843 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -58.65 -48.24 81.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.9 mmt -70.1 143.68 52.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.73 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -160.43 31.06 0.16 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.39 0.614 . . . . 0.0 110.501 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -98.0 162.06 13.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.523 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 90.9 p -161.35 170.67 19.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 -179.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -60.18 -39.59 96.12 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 8.7 m -90.97 -158.3 0.55 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.6 tttt 65.53 108.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.618 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.23 36.85 28.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.405 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.89 150.03 33.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.571 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 93.7 m -71.13 130.9 42.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.789 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 93.92 112.74 2.34 Favored Glycine 0 N--CA 1.46 0.233 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -156.65 154.04 29.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.977 0.418 . . . . 0.0 110.308 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -90.12 31.16 1.01 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.827 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.638 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -63.03 -12.34 25.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.443 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.458 HD23 ' HG3' ' A' ' 63' ' ' GLU . 38.6 mt -49.41 -23.16 1.38 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.989 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -59.24 -44.43 92.35 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.835 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.9 -41.78 5.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -162.81 -87.55 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.638 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.5 OUTLIER 168.36 -80.06 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.765 0.666 . . . . 0.0 111.269 179.788 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -113.79 164.05 14.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.163 0.506 . . . . 0.0 110.149 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.451 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 13.6 t -79.41 138.58 37.68 Favored 'General case' 0 C--O 1.211 -0.929 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.851 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.67 -35.82 81.45 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.741 -0.266 . . . . 0.0 112.747 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 71.2 t -59.09 -43.8 90.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 9.9 p -109.5 -18.43 13.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.837 0.351 . . . . 0.0 111.587 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 64.93 30.19 12.05 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.933 178.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -119.7 148.58 43.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.282 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -54.27 150.83 8.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.626 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 78' ' ' PRO . 57.7 mt -80.48 105.54 11.81 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.696 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.445 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 2.9 ptm180 -80.83 167.13 34.68 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.165 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -52.29 -46.83 30.29 Favored 'Trans proline' 0 N--CA 1.502 2.005 0 C-N-CA 122.607 2.204 . . . . 0.0 113.033 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.7 mt-10 -82.8 0.07 45.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.204 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.21 -24.46 64.94 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 47.14 73.09 1.06 Allowed Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.283 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.494 ' HB3' HD13 ' A' ' 72' ' ' LEU . 46.9 Cg_endo -68.36 147.9 72.69 Favored 'Trans proline' 0 C--N 1.299 -2.063 0 C-N-CA 122.711 2.274 . . . . 0.0 112.008 -179.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.85 156.08 45.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.792 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.4 tp -106.88 127.33 53.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.27 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.575 HD11 HD22 ' A' ' 92' ' ' LEU . 2.5 mp -86.39 167.06 24.8 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.023 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.69 -20.32 64.86 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.984 2.456 . . . . 0.0 112.224 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 7.2 p -89.64 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.63 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 tt 73.02 50.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.994 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.509 ' CE1' HG11 ' A' ' 119' ' ' VAL . 51.9 m170 -128.97 124.4 34.92 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.868 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -85.79 132.89 34.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.767 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -151.16 165.54 33.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.043 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.437 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 3.9 m -71.11 136.75 48.36 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.822 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.8 t -53.95 -43.29 69.74 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.031 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.28 -39.16 89.39 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 85.3 m -68.09 -33.65 74.93 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.241 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.767 HD21 ' HB3' ' A' ' 87' ' ' ALA . 84.9 mt -67.19 -28.76 68.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.178 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.402 ' N ' ' HD2' ' A' ' 94' ' ' PRO . . . -53.57 -60.51 8.16 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.392 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 93' ' ' GLY . 30.8 Cg_endo -64.56 -10.34 24.02 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 122.633 2.222 . . . . 0.0 112.624 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -58.51 -30.17 66.85 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.789 0.328 . . . . 0.0 110.219 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.437 ' HB2' HG13 ' A' ' 115' ' ' VAL . . . -117.3 148.73 43.22 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.449 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -76.09 152.16 35.53 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.517 2.145 . . . . 0.0 112.466 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -156.11 146.13 21.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.482 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 48.16 42.85 18.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.612 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -117.38 -165.45 1.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.637 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -59.85 -39.36 84.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.479 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.9 t -60.67 139.59 57.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.1 t -144.19 143.53 31.12 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.336 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -61.26 -43.37 99.47 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.68 -41.97 99.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.983 0.421 . . . . 0.0 110.449 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.07 -38.22 96.22 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.68 14.81 39.24 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 110.674 -0.971 . . . . 0.0 110.674 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -67.92 142.74 55.94 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-O 120.833 0.349 . . . . 0.0 110.763 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.22 148.58 48.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 91.26 168.61 41.68 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.1 t0 61.16 76.69 0.36 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.831 0.348 . . . . 0.0 110.915 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 107.77 -17.52 35.76 Favored Glycine 0 CA--C 1.519 0.298 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 77.3 p -115.83 -120.6 0.3 Allowed 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 123' ' ' GLN . 78.4 t -65.0 137.2 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 CA-C-O 120.964 0.411 . . . . 0.0 110.525 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.533 HG21 HG21 ' A' ' 129' ' ' ILE . 96.8 t -106.48 142.41 19.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.408 -179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -84.87 114.73 22.32 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.478 0.656 . . . . 0.0 111.009 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.4 t -104.56 132.97 20.44 Favored Pre-proline 0 C--O 1.206 -1.229 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.216 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.11 -16.3 26.72 Favored 'Trans proline' 0 C--N 1.297 -2.15 0 C-N-CA 121.216 1.278 . . . . 0.0 112.626 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.509 HG11 ' CE1' ' A' ' 85' ' ' HIS . 16.4 t -96.39 -51.72 10.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.35 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -31.7 11.67 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.953 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 117' ' ' CYS . 3.0 mptt 59.46 22.82 11.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.12 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -172.8 97.86 0.13 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.233 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.588 ' O ' HG13 ' A' ' 114' ' ' VAL . 28.6 mm100 -89.52 145.81 25.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.857 0.361 . . . . 0.0 110.374 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 88.5 m -61.03 -46.52 90.41 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.498 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -145.93 178.0 8.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.918 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.543 ' HA ' HG23 ' A' ' 129' ' ' ILE . 1.2 p -116.28 36.85 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.48 0.657 . . . . 0.0 111.64 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -89.65 -31.22 17.62 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.623 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -108.86 20.75 18.1 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.656 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.543 HG23 ' HA ' ' A' ' 126' ' ' SER . 24.2 pt -71.25 -169.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.524 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -37.68 108.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 O-C-N 123.8 0.688 . . . . 0.0 110.12 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 164.74 -31.57 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 124.818 1.324 . . . . 0.0 111.321 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -93.47 85.87 5.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.958 -0.697 . . . . 0.0 111.29 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -93.19 137.38 32.57 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.909 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -94.85 -75.78 0.51 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.815 0.34 . . . . 0.0 110.51 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 28.1 ttt -146.02 142.54 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 72.7 mtm180 -83.93 64.98 8.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.355 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.64 122.34 13.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.173 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 170.42 -66.66 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.792 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . -60.17 -39.5 95.97 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 36.1 t -57.81 -25.69 60.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.029 0.442 . . . . 0.0 110.435 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -58.7 -41.18 85.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.241 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -126.63 39.65 3.88 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.923 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.93 -39.19 88.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.46 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.8 m -60.9 -44.39 97.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 37.1 t0 . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.677 179.758 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -107.15 -118.07 4.3 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 138' ' ' SER . . . -60.89 141.82 56.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.78 0.324 . . . . 0.0 110.602 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -90.8 28.81 1.45 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.724 0.774 . . . . 0.0 110.681 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.659 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -62.55 -11.99 19.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.409 HD23 ' HG3' ' A' ' 63' ' ' GLU . 36.5 mt -48.58 -23.59 1.05 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.277 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -58.97 -43.35 91.32 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.0 110.594 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.442 HD11 ' CG ' ' A' ' 134' ' ' PHE . 69.9 mt -104.6 -41.06 5.8 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.022 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.23 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.659 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 165.45 -78.13 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.117 0 O-C-N 123.953 0.783 . . . . 0.0 110.75 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 22.5 p-80 -107.88 165.98 11.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.444 0.64 . . . . 0.0 110.824 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.543 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 13.3 t -81.12 137.14 35.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.563 -179.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.81 -37.98 93.92 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.676 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.488 HG22 ' HG3' ' A' ' 118' ' ' PRO . 73.1 t -59.93 -40.81 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 8.4 p -112.64 -18.63 12.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.943 0.401 . . . . 0.0 111.109 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.32 39.62 9.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.309 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -128.49 146.79 50.71 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.216 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -55.99 144.42 28.72 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.633 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.521 HD13 ' HB3' ' A' ' 78' ' ' PRO . 80.7 mt -71.19 105.85 3.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.447 -179.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.463 ' HG3' ' H ' ' A' ' 75' ' ' GLU . 3.5 ptm180 -79.93 165.8 44.84 Favored Pre-proline 0 C--N 1.333 -0.133 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.554 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -53.05 -43.53 56.24 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 122.432 2.088 . . . . 0.0 113.31 -177.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.463 ' H ' ' HG3' ' A' ' 73' ' ' ARG . 99.2 mt-10 -88.15 2.26 52.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -66.01 -24.98 66.87 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.983 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 50.56 69.0 2.87 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 109.791 -179.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.521 ' HB3' HD13 ' A' ' 72' ' ' LEU . 51.2 Cg_endo -68.9 150.81 73.72 Favored 'Trans proline' 0 C--N 1.293 -2.386 0 C-N-CA 122.628 2.219 . . . . 0.0 111.078 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.32 165.49 29.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.673 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 25.6 tp -114.35 130.19 56.67 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.914 0.388 . . . . 0.0 111.189 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.516 HD11 HD22 ' A' ' 92' ' ' LEU . 3.7 mp -90.16 164.54 27.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.242 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.51 -6.2 18.6 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.043 2.495 . . . . 0.0 112.33 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.77 0.91 55.33 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.376 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 77.65 41.54 0.13 Allowed 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 123.825 0.703 . . . . 0.0 111.338 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.463 ' NE2' HG11 ' A' ' 119' ' ' VAL . 34.4 m170 -135.29 119.85 18.14 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.995 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -86.52 141.64 28.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.9 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.787 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -157.63 166.86 31.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.875 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . 0.47 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 4.2 m -65.77 137.05 56.99 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.9 t -56.72 -42.19 78.76 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.069 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.71 -40.27 91.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 80.8 m -66.83 -36.25 81.92 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.204 178.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.787 HD21 ' HB3' ' A' ' 87' ' ' ALA . 82.0 mt -66.09 -30.55 71.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.27 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -48.95 -62.35 4.65 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.866 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.38 -17.29 59.37 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.131 1.887 . . . . 0.0 112.05 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -60.01 -37.28 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.328 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.16 122.31 85.13 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.152 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.17 141.71 79.59 Favored 'Trans proline' 0 N--CA 1.5 1.862 0 C-N-CA 121.969 1.78 . . . . 0.0 112.189 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -148.03 -64.54 0.26 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.663 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.9 92.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.63 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -118.61 149.33 41.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.334 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -61.34 -39.8 91.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.6 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.1 t 64.59 117.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.593 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 70.8 m -64.16 145.05 56.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.74 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -176.87 172.95 45.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -77.09 -1.57 29.78 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.34 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -91.9 61.96 2.63 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.476 -1.049 . . . . 0.0 110.476 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.0 24.98 76.16 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.09 23.67 14.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.302 . . . . 0.0 110.543 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 147.56 23.02 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.878 0.37 . . . . 0.0 110.538 179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -116.04 -146.76 8.76 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.6 t0 73.03 81.65 0.13 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.783 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 106.31 -17.4 40.48 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 75.6 p -115.7 -122.16 0.29 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.9 m -63.3 142.91 16.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.807 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.535 HG23 ' OG ' ' A' ' 126' ' ' SER . 56.4 t -113.63 140.72 32.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.421 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -87.74 129.25 35.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.537 0.684 . . . . 0.0 109.913 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.474 ' O ' ' N ' ' A' ' 121' ' ' LYS . 35.0 t -116.12 131.41 23.78 Favored Pre-proline 0 C--O 1.195 -1.765 0 CA-C-N 114.805 -1.088 . . . . 0.0 108.226 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.488 ' HG3' HG22 ' A' ' 67' ' ' VAL . 23.9 Cg_endo -59.6 -11.5 14.44 Favored 'Trans proline' 0 C--N 1.295 -2.25 0 CA-C-N 121.502 1.572 . . . . 0.0 113.176 -178.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.463 HG11 ' NE2' ' A' ' 85' ' ' HIS . 21.4 t -84.01 -44.82 18.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.541 -0.463 . . . . 0.0 111.7 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.55 -30.69 5.1 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.644 0.735 . . . . 0.0 110.02 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.2 OUTLIER 64.24 31.44 13.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.073 178.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -162.72 139.43 7.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.996 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -143.05 161.49 38.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.077 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 80.4 m -96.48 -43.16 7.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.998 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -142.34 175.05 10.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.251 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.535 ' OG ' HG23 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -125.06 42.71 3.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.336 0.588 . . . . 0.0 111.217 179.6 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -85.75 -15.45 42.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.031 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -114.33 22.48 13.69 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 39.6 pt -69.12 -173.65 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.774 0.321 . . . . 0.0 111.144 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.462 HG12 HD12 ' A' ' 92' ' ' LEU . 2.3 m -45.47 105.61 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.284 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.572 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 168.26 -32.16 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 124.152 0.908 . . . . 0.0 110.576 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -93.31 64.95 3.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.154 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -60.83 139.37 57.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.394 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . 0.442 ' CG ' HD11 ' A' ' 61' ' ' LEU . 80.7 t80 -93.56 -72.95 0.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.485 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.7 ttt -150.79 144.86 25.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.596 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -122.48 99.69 6.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -135.75 34.6 2.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.696 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 56' ' ' ALA . 15.5 m -49.81 -73.34 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 59.18 17.15 36.74 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 85.7 p -88.6 -13.6 39.58 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.698 0.285 . . . . 0.0 111.294 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -73.43 130.24 39.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.431 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -94.18 125.43 38.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -59.93 -28.44 67.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.425 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.5 m -60.08 -42.11 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 55.6 p-10 . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.682 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.659 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 94.23 163.04 35.69 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -139.19 140.42 37.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.794 0.331 . . . . 0.0 110.366 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.1 mp0 -94.41 30.26 2.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.77 0.795 . . . . 0.0 110.148 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -61.8 -11.98 15.04 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.447 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.425 HD23 ' HG3' ' A' ' 63' ' ' GLU . 43.8 mt -47.51 -24.07 0.77 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.309 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -58.98 -41.74 88.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.331 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 mp -104.42 -40.91 5.9 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.934 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -168.55 -85.49 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 0.8 OUTLIER 164.7 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 O-C-N 124.136 0.898 . . . . 0.0 110.905 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -107.88 162.37 14.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.306 0.574 . . . . 0.0 110.699 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 30.5 t -73.31 134.9 44.31 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.544 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.5 -30.07 71.28 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.775 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.1 t -64.11 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.06 -15.47 11.14 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 110.972 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 63.33 41.09 8.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.254 0.55 . . . . 0.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -126.19 144.97 50.57 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.196 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -52.57 151.98 3.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.64 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 82.3 mt -85.87 102.28 13.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.017 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -75.9 160.22 79.14 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.854 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -57.59 -33.16 96.15 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.161 1.907 . . . . 0.0 111.319 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -89.03 -8.17 54.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.449 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -67.78 -24.33 65.31 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.911 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 51.09 73.6 0.95 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.479 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.04 149.43 71.49 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.706 2.27 . . . . 0.0 111.739 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.423 ' CZ ' HG23 ' A' ' 130' ' ' VAL . 96.0 mtt180 -141.54 141.58 33.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.306 -178.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.8 tp -92.65 129.22 38.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.47 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 mp -85.59 165.37 35.81 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.27 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -62.68 -18.33 63.5 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.175 2.583 . . . . 0.0 112.34 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.64 2.7 55.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.103 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 74.7 47.68 0.12 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.206 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -133.91 124.75 26.94 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.472 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 36.9 m -85.06 138.49 32.4 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.987 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.594 ' HB3' HD12 ' A' ' 92' ' ' LEU . . . -147.98 160.88 42.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.314 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 6.3 m -62.67 151.83 37.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.5 t -58.74 -47.56 84.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.985 0.422 . . . . 0.0 110.582 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.79 -42.44 95.05 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.817 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 95.8 m -67.07 -23.72 65.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.204 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.594 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -64.56 -32.11 73.62 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.126 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.49 -65.14 3.44 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 95' ' ' ALA . 22.0 Cg_exo -64.37 110.5 1.4 Allowed 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.689 2.26 . . . . 0.0 111.492 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.669 ' HB1' ' O ' ' A' ' 116' ' ' ASP . . . 169.56 -71.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.629 0.581 . . . . 0.0 110.057 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.742 ' HB2' HG22 ' A' ' 115' ' ' VAL . . . -60.06 -60.18 11.44 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.919 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.518 ' CD ' ' HB3' ' A' ' 96' ' ' ALA . 8.3 Cg_endo -48.7 131.3 24.11 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.491 2.127 . . . . 0.0 112.442 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 48.86 38.47 12.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.621 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 96' ' ' ALA . . . -64.99 134.09 53.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.248 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . 53.08 22.69 2.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.312 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 61.4 m-80 -107.83 108.59 19.85 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.589 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.0 m -63.63 -40.39 96.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 91.5 p -62.39 -38.05 88.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -12.2 66.43 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -64.04 -39.58 94.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.79 0.328 . . . . 0.0 110.547 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 148.72 -168.41 29.27 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.39 172.59 41.71 Favored Glycine 0 CA--C 1.525 0.719 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.45 -39.91 92.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.718 0.294 . . . . 0.0 110.709 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -112.5 143.58 43.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.681 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 101.23 174.86 28.84 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.37 73.55 0.29 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.026 0.441 . . . . 0.0 110.628 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 102.98 -13.44 56.06 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.0 p -114.68 -118.94 0.31 Allowed 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.428 ' H ' HG13 ' A' ' 114' ' ' VAL . 3.7 m -61.3 141.83 16.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.742 HG22 ' HB2' ' A' ' 96' ' ' ALA . 58.5 t -107.74 134.01 50.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.117 -178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.669 ' O ' ' HB1' ' A' ' 95' ' ' ALA . 15.8 t70 -81.37 108.66 15.17 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.968 0.889 . . . . 0.0 110.54 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 121' ' ' LYS . 36.6 t -95.83 131.76 28.55 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.787 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.97 -12.07 14.21 Favored 'Trans proline' 0 C--N 1.297 -2.147 0 C-N-CA 121.003 1.136 . . . . 0.0 112.771 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.44 -61.58 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.504 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 9.3 p -98.7 -25.35 14.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.953 0.406 . . . . 0.0 110.85 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 117' ' ' CYS . 2.7 mptt 55.74 32.66 19.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -165.27 137.47 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.03 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -144.6 142.08 29.9 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.911 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 98.7 m -70.86 -44.63 66.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.011 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -145.49 178.07 8.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.711 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.54 48.86 1.52 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.481 0.658 . . . . 0.0 111.516 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.01 -29.7 21.77 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.282 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -103.86 20.49 18.02 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.904 0.383 . . . . 0.0 111.392 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.6 pt -62.9 -168.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.483 ' HB ' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -35.31 116.5 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.553 0 O-C-N 124.054 0.846 . . . . 0.0 110.437 -179.756 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 161.63 -32.52 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.465 0 O-C-N 124.986 1.429 . . . . 0.0 110.013 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -85.59 60.02 5.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.228 -177.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -97.25 28.59 3.56 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.473 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -59.48 -48.04 83.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 1.6 mmt -78.83 121.1 24.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.237 0.541 . . . . 0.0 110.844 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -153.35 104.34 2.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.22 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -108.4 -80.93 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.133 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 18.6 p 42.93 80.48 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.339 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 67.03 23.88 73.0 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 54.1 m 56.94 33.6 23.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.732 0.301 . . . . 0.0 110.364 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm -94.98 87.39 4.92 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -158.4 156.66 30.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.416 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -99.35 126.96 45.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.605 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 64.2 p -86.38 -15.16 41.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.548 179.936 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.703 0 N-CA-C 110.784 -0.927 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' O ' ' HB3' ' A' ' 56' ' ' ALA . . . 72.91 25.14 74.58 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 55' ' ' GLY . . . 65.63 117.57 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.065 0.46 . . . . 0.0 109.799 -179.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.96 19.82 1.31 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.093 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.652 ' HB3' ' HA ' ' A' ' 63' ' ' GLU . . . -59.81 -12.67 7.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.632 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.414 HD23 ' HG3' ' A' ' 63' ' ' GLU . 44.3 mt -47.93 -24.02 0.93 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.461 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -59.39 -41.58 89.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.067 0.46 . . . . 0.0 110.382 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -104.0 -40.43 6.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.869 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.35 -86.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.652 ' HA ' ' HB3' ' A' ' 58' ' ' ALA . 1.5 mt-10 164.29 -78.95 0.0 OUTLIER 'General case' 0 CA--C 1.527 0.064 0 O-C-N 124.037 0.835 . . . . 0.0 110.823 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -106.17 163.09 13.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.315 0.579 . . . . 0.0 110.72 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -76.73 135.1 39.02 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.216 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.86 -37.94 94.93 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.634 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.494 HG22 ' HG2' ' A' ' 118' ' ' PRO . 78.2 t -60.41 -40.32 83.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -176.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 7.7 p -113.07 -17.79 12.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.956 0.408 . . . . 0.0 110.939 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 63.23 41.31 8.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.368 179.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -129.76 147.8 51.57 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.161 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.8 tpp85 -54.26 144.74 19.39 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.941 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.9 mt -75.53 102.85 5.4 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.24 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -78.83 164.28 56.13 Favored Pre-proline 0 C--N 1.331 -0.207 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.86 -48.28 17.23 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 C-N-CA 121.44 1.427 . . . . 0.0 112.668 -178.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -72.2 -4.87 31.89 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.968 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -67.34 -25.14 65.85 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.777 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 51.78 72.11 1.3 Allowed Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.255 -178.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.81 148.2 76.57 Favored 'Trans proline' 0 C--N 1.297 -2.157 0 C-N-CA 122.711 2.274 . . . . 0.0 112.102 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -139.52 160.89 38.8 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.161 -178.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.2 tp -115.31 127.85 55.71 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.013 0.435 . . . . 0.0 111.019 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.3 mp -87.39 164.59 34.75 Favored Pre-proline 0 N--CA 1.467 0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.097 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -71.57 -6.67 19.63 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 123.061 2.508 . . . . 0.0 112.408 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -94.5 0.1 55.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 78.33 41.67 0.11 Allowed 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.947 0.779 . . . . 0.0 111.221 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.465 ' CD2' HG11 ' A' ' 119' ' ' VAL . 33.8 m170 -134.79 123.94 24.36 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.515 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.5 m -86.83 143.49 27.45 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.828 -0.749 . . . . 0.0 109.719 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.64 ' HB3' ' CD1' ' A' ' 92' ' ' LEU . . . -150.49 164.48 35.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.992 -179.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 21.1 m -66.85 151.08 48.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.181 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.3 p -61.8 -42.24 98.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.616 0.722 . . . . 0.0 109.878 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.46 95.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.268 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.92 -31.85 69.83 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.775 0.798 . . . . 0.0 109.963 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.64 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -63.46 -37.14 86.16 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.429 -179.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -49.64 -62.31 4.94 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 120.508 -0.853 . . . . 0.0 111.203 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.21 -22.6 66.89 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 122.08 1.854 . . . . 0.0 111.467 179.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 92' ' ' LEU . . . -59.65 -38.9 82.67 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.934 179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.43 118.33 66.29 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.962 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -55.82 141.5 85.04 Favored 'Trans proline' 0 N--CA 1.499 1.828 0 C-N-CA 121.966 1.777 . . . . 0.0 112.381 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -90.64 -25.01 20.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.68 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.54 139.54 33.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.445 ' HB2' ' HB3' ' A' ' 111' ' ' ASP . . . -141.35 137.92 32.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 0.0 110.756 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.5 t-20 -62.35 -40.37 96.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.615 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.3 t 68.04 45.62 1.3 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.236 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 48.4 t -150.85 150.14 30.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.411 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.77 17.18 75.78 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.484 -0.646 . . . . 0.0 111.484 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 44.5 t0 55.62 60.04 3.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.652 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 95.69 16.42 39.46 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.5 -0.21 71.99 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.601 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.559 ' O ' HG21 ' A' ' 113' ' ' THR . . . -58.35 139.04 56.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.975 0.388 . . . . 0.0 110.483 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.2 -40.03 94.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.76 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -140.39 173.19 23.18 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.445 ' HB3' ' HB2' ' A' ' 100' ' ' ALA . 34.6 t0 74.57 83.24 0.11 Allowed 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.895 0.409 . . . . 0.0 111.957 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.3 -9.44 45.78 Favored Glycine 0 CA--C 1.519 0.294 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.559 HG21 ' O ' ' A' ' 108' ' ' ALA . 2.1 t -116.69 -118.57 0.32 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.33 151.53 4.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.358 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 58.7 t -112.71 135.36 52.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.099 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -77.62 104.22 8.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.55 0.69 . . . . 0.0 109.553 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.429 ' O ' ' N ' ' A' ' 121' ' ' LYS . 13.1 t -100.13 116.99 64.02 Favored Pre-proline 0 C--O 1.204 -1.296 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.637 -179.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.494 ' HG2' HG22 ' A' ' 67' ' ' VAL . 38.6 Cg_exo -53.2 -16.06 6.24 Favored 'Trans proline' 0 C--N 1.297 -2.142 0 CA-C-N 121.068 1.417 . . . . 0.0 113.47 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.465 HG11 ' CD2' ' A' ' 85' ' ' HIS . 23.3 t -79.03 -62.11 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.742 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.8 p -99.73 -29.13 12.82 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.463 0.649 . . . . 0.0 109.826 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.429 ' N ' ' O ' ' A' ' 117' ' ' CYS . 0.4 OUTLIER 63.94 33.1 12.69 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.22 178.78 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -164.63 138.6 5.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.998 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -145.4 165.57 28.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.993 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.3 m -95.92 -50.99 4.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.357 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -142.45 176.24 9.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.736 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.37 34.48 4.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.428 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.5 ptmt -77.18 -22.53 52.31 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.21 22.3 14.91 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.448 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 45.5 pt -65.98 -168.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -36.39 115.32 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 O-C-N 124.066 0.854 . . . . 0.0 110.666 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 164.19 -31.76 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 124.914 1.384 . . . . 0.0 109.871 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -86.14 60.19 6.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.934 -178.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -91.31 36.96 0.93 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.712 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.87 -48.4 81.52 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.235 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 27.0 mmt -84.49 139.32 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.071 0.462 . . . . 0.0 111.029 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 96.5 mtm-85 -148.35 48.58 1.04 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.508 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.07 159.28 15.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.534 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.3 p -161.56 -39.4 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.821 0.344 . . . . 0.0 110.949 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 80.77 -3.96 72.24 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 86.1 p -107.84 4.33 25.35 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.726 -0.279 . . . . 0.0 110.884 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -64.27 130.34 43.47 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.983 0.421 . . . . 0.0 110.763 -179.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -67.28 145.19 55.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.394 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -144.21 148.93 35.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.479 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 63.5 p -130.91 160.47 34.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.509 -179.992 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_